0 B13R1.42 C=C(\C=C\c1ccccc1)CCN Amb33081079 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.42 C=CNC(=O)\C=C\c1ccccc1 Amb26908425 [0,0,0,0,0,0|1,0,2]=3 2 B13R1.42 C=COC(=O)CCc1ccccc1 Amb21858909 [0,0,0,0,0,0|0,0,4]=4 3 B13R1.42 C=COC(=O)OCc1ccccc1 Amb8471025 [0,0,0,0,0,0|1,0,3]=4 4 B13R1.42 CC#CC(=O)C#Cc1ccccc1 Amb27476271 [0,0,0,0,0,0|1,0,3]=4 5 B13R1.42 CC#CC(=O)CCc1ccccc1 Amb17619342 [0,0,0,0,0,0|1,0,3]=4 6 B13R1.42 CC#CC(=O)NNc1ccccc1 Amb27218830 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.42 CC(\C=C\c1ccccc1)CCN Amb33081133 [0,0,0,0,0,0|3,0,1]=4 8 B13R1.42 CCCC(=N)NCc1ccccc1 Amb27973328 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.42 CCCC(=O)C#Cc1ccccc1 Amb17594320 [0,0,0,0,0,0|1,0,2]=3 10 B13R1.42 CCCC(=O)CCc1ccccc1 Amb9031589 [0,0,0,0,0,0|1,0,2]=3 11 B13R1.42 CCCC(=O)CSc1ccccc1 Amb18330492 [0,0,0,0,0,0|2,0,1]=3 12 B13R1.42 CCCC(=O)NCc1ccccc1 Amb2701481 [0,0,0,0,0,0|2,0,1]=3 13 B13R1.42 CCCC(=O)NNc1ccccc1 Amb4081014 [0,0,0,0,0,0|3,0,0]=3 14 B13R1.42 CCCC(=O)NNc1ccncc1 Amb28051157 [0,0,0,0,0,0|4,0,0]=4 15 B13R1.42 CCCC(=O)OCc1ccccc1 Amb6357333 [0,0,0,0,0,0|2,0,1]=3 16 B13R1.42 CCC\C(C)=N\Nc1ccccc1 Amb27806061 [0,0,0,0,0,0|4,0,0]=4 17 B13R1.42 CCC\C(N)=N\Nc1ccccc1 Amb27180324 [0,0,0,0,0,0|4,0,0]=4 18 B13R1.42 CCNC(=N)NCc1ccccc1 Amb18804667 [0,0,0,0,0,0|3,0,1]=4 19 B13R1.42 CCNC(=O)C#Cc1ccccc1 Amb27230535 [0,0,0,0,0,0|1,0,2]=3 20 B13R1.42 CCNC(=O)CCc1ccccc1 Amb6542498 [0,0,0,0,0,0|1,0,2]=3 21 B13R1.42 CCNC(=O)CNc1ccccc1 Amb6477739 [0,0,0,0,0,0|2,0,1]=3 22 B13R1.42 CCNC(=O)CNc1ccccn1 Amb9253323 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.42 CCNC(=O)NCc1ccncc1 Amb24383174 [0,0,0,0,0,0|3,0,1]=4 24 B13R1.42 CCNC(=O)NNc1ccccc1 Amb24710661 [0,0,0,0,0,0|3,0,0]=3 25 B13R1.42 CCNC(=O)NNc1ccccn1 Amb27809493 [0,0,0,0,0,0|4,0,0]=4 26 B13R1.42 CCNC(=O)OCc1ccccc1 Amb24375743 [0,0,0,0,0,0|2,0,1]=3 27 B13R1.42 CCNC(=O)\C=C\c1ccccc1 Amb3358403 [0,0,0,0,0,0|1,0,0]=1 28 B13R1.42 CCNC(=O)\C=C\c1ccncn1 Amb28051284 [0,0,0,0,0,0|3,0,0]=3 29 B13R1.42 CCNC(=O)\C=C\c1cnccn1 Amb28051285 [0,0,0,0,0,0|3,0,0]=3 30 B13R1.42 CCNC(=S)NNc1ccccc1 Amb2762753 [0,0,0,0,0,0|3,1,0]=4 31 B13R1.42 CCOC(=N)CCc1ccccn1 Amb24094195 [0,0,0,0,0,0|2,0,2]=4 32 B13R1.42 CCOC(=N)CCc1ccncc1 Amb24094201 [0,0,0,0,0,0|2,0,2]=4 33 B13R1.42 CCOC(=O)C#Cc1ccccc1 Amb2721509 [0,0,0,0,0,0|0,0,2]=2 34 B13R1.42 CCOC(=O)C#Cc1ccccn1 Amb24494363 [0,0,0,0,0,0|1,0,2]=3 35 B13R1.42 CCOC(=O)C#Cc1cccnc1 Amb27259063 [0,0,0,0,0,0|1,0,2]=3 36 B13R1.42 CCOC(=O)C#Cc1cccnn1 Amb33168725 [0,0,0,0,0,0|2,0,2]=4 37 B13R1.42 CCOC(=O)C#Cc1ccncc1 Amb26471725 [0,0,0,0,0,0|1,0,2]=3 38 B13R1.42 CCOC(=O)C#Cc1ccncn1 Amb33168720 [0,0,0,0,0,0|2,0,2]=4 39 B13R1.42 CCOC(=O)C#Cc1ccnnc1 Amb33168671 [0,0,0,0,0,0|2,0,2]=4 40 B13R1.42 CCOC(=O)C#Cc1cnccn1 Amb27167525 [0,0,0,0,0,0|2,0,2]=4 41 B13R1.42 CCOC(=O)C#Cc1cncnc1 Amb24668597 [0,0,0,0,0,0|2,0,2]=4 42 B13R1.42 CCOC(=O)C#Cc1ncccn1 Amb33168722 [0,0,0,0,0,0|2,0,2]=4 43 B13R1.42 CCOC(=O)CCc1ccccc1 Amb3940133 [0,0,0,0,0,0|0,0,2]=2 44 B13R1.42 CCOC(=O)CCc1ccccn1 Amb5721889 [0,0,0,0,0,0|1,0,2]=3 45 B13R1.42 CCOC(=O)CCc1ncccn1 Amb24061350 [0,0,0,0,0,0|2,0,2]=4 46 B13R1.42 CCOC(=O)CNc1ccccc1 Amb1025527 [0,0,0,0,0,0|1,0,1]=2 47 B13R1.42 CCOC(=O)CNc1ccccc1 Amb21961619 [0,0,0,0,0,0|1,0,1]=2 48 B13R1.42 CCOC(=O)CNc1ccccn1 Amb18181060 [0,0,0,0,0,0|2,0,1]=3 49 B13R1.42 CCOC(=O)CNc1cccnc1 Amb24180824 [0,0,0,0,0,0|2,0,1]=3 50 B13R1.42 CCOC(=O)CNc1ccncc1 Amb18181061 [0,0,0,0,0,0|2,0,1]=3 51 B13R1.42 CCOC(=O)CNc1ncccn1 Amb18181292 [0,0,0,0,0,0|3,0,1]=4 52 B13R1.42 CCOC(=O)COc1ccccc1 Amb2687923 [0,0,0,0,0,0|1,0,1]=2 53 B13R1.42 CCOC(=O)COc1ccccn1 Amb22493952 [0,0,0,0,0,0|2,0,1]=3 54 B13R1.42 CCOC(=O)COc1cccnc1 Amb836907 [0,0,0,0,0,0|2,0,1]=3 55 B13R1.42 CCOC(=O)CSc1ccccc1 Amb2408276 [0,0,0,0,0,0|1,0,1]=2 56 B13R1.42 CCOC(=O)CSc1ccccn1 Amb6504909 [0,0,0,0,0,0|2,0,1]=3 57 B13R1.42 CCOC(=O)CSc1cccnc1 Amb24103483 [0,0,0,0,0,0|2,0,1]=3 58 B13R1.42 CCOC(=O)NCc1ccccc1 Amb2736961 [0,0,0,0,0,0|1,0,1]=2 59 B13R1.42 CCOC(=O)NCc1cnccn1 Amb24103463 [0,0,0,0,0,0|3,0,1]=4 60 B13R1.42 CCOC(=O)NNc1cccnn1 Amb28051308 [0,0,0,0,0,0|4,0,0]=4 61 B13R1.42 CCOC(=O)NNc1ncccn1 Amb28051309 [0,0,0,0,0,0|4,0,0]=4 62 B13R1.42 CCOC(=O)NSc1ccccn1 Amb24103464 [0,0,0,0,0,0|3,0,0]=3 63 B13R1.42 CCOC(=O)OCc1ccccc1 Amb27166327 [0,0,0,0,0,0|1,0,1]=2 64 B13R1.42 CCOC(=O)\C=C\c1ccccc1 Amb6296621 [0,0,0,0,0,0|0,0,0]=0 65 B13R1.42 CCOC(=O)\C=C\c1ccccn1 Amb33996583 [0,0,0,0,0,0|1,0,0]=1 66 B13R1.42 CCOC(=O)\C=C\c1cccnc1 Amb15695192 [0,0,0,0,0,0|1,0,0]=1 67 B13R1.42 CCOC(=O)\C=C\c1ccncc1 Amb33870677 [0,0,0,0,0,0|1,0,0]=1 68 B13R1.42 CCOC(=O)\C=N\c1ccccc1 Amb2609189 [0,0,0,0,0,0|1,0,0]=1 69 B13R1.42 CCOC(C)OCc1ccccc1 Amb28247923 [0,0,0,0,0,0|2,0,2]=4 70 B13R1.42 CCSC(=N)NCc1ccccc1 Amb24399348 [0,0,0,0,0,0|2,1,1]=4 71 B13R1.42 CCSC(=S)NNc1ccccc1 Amb25218192 [0,0,0,0,0,0|2,2,0]=4 72 B13R1.42 CNCC(=O)NCc1ccccc1 Amb21959039 [0,0,0,0,0,0|3,0,1]=4 73 B13R1.42 CNCC(=O)NCc1ccccc1 Amb6276572 [0,0,0,0,0,0|3,0,1]=4 74 B13R1.42 CNCC(=O)OCc1ccccc1 Amb18809175 [0,0,0,0,0,0|3,0,1]=4 75 B13R1.42 CNCC(=O)OCc1ccccc1 Amb21929370 [0,0,0,0,0,0|3,0,1]=4 76 B13R1.42 CNCC(=O)OCc1ccccc1 Amb22002169 [0,0,0,0,0,0|3,0,1]=4 77 B13R1.42 CNCC(=O)\C=C\c1ccccc1 Amb33081764 [0,0,0,0,0,0|2,0,0]=2 78 B13R1.42 CNCC(O)\C=C\c1ccccc1 Amb33081784 [0,0,0,0,0,0|2,0,2]=4 79 B13R1.42 CNNC(=O)NCc1ccccc1 Amb26951702 [0,0,0,0,0,0|3,0,1]=4 80 B13R1.42 CNNC(=O)OCc1ccccc1 Amb27441289 [0,0,0,0,0,0|3,0,1]=4 81 B13R1.42 CNNC(=O)OCc1ccccc1 Amb32668702 [0,0,0,0,0,0|3,0,1]=4 82 B13R1.42 COCC(=O)C#Cc1ccccc1 Amb28199861 [0,0,0,0,0,0|2,0,2]=4 83 B13R1.42 COCC(=O)CSc1ccccc1 Amb32683206 [0,0,0,0,0,0|3,0,1]=4 84 B13R1.42 COCC(=O)NCc1ccccc1 Amb2661100 [0,0,0,0,0,0|3,0,1]=4 85 B13R1.42 CONC(=O)C#Cc1ccccc1 Amb27804951 [0,0,0,0,0,0|2,0,2]=4 86 B13R1.42 CONC(=O)CNc1ccccc1 Amb28188422 [0,0,0,0,0,0|3,0,1]=4 87 B13R1.42 CONC(=O)OCc1ccccc1 Amb16969956 [0,0,0,0,0,0|3,0,1]=4 88 B13R1.42 CONC(=O)\C=C\c1ccccc1 Amb28064704 [0,0,0,0,0,0|2,0,0]=2 89 B13R1.42 CONC(=O)\C=C\c1ccccn1 Amb27834715 [0,0,0,0,0,0|3,0,0]=3 90 B13R1.42 CONC(=O)\C=C\c1cnccn1 Amb28051402 [0,0,0,0,0,0|4,0,0]=4 91 B13R1.42 CSCC(=O)NCc1ccccc1 Amb19382179 [0,0,0,0,0,0|3,0,1]=4 92 B13R1.42 CSCC(=O)OCc1ccccc1 Amb27769587 [0,0,0,0,0,0|3,0,1]=4 93 B13R1.42 C\C=C\C(=O)NCc1ccccc1 Amb1196143 [0,0,0,0,0,0|2,0,2]=4 94 B13R1.42 C\C=C\C(=O)NNc1ccccc1 Amb17777823 [0,0,0,0,0,0|3,0,1]=4 95 B13R1.42 C\C=C\C(=O)OCc1ccccc1 Amb10572342 [0,0,0,0,0,0|2,0,2]=4 96 B13R1.42 C\C=C\C(=O)\C=C\c1ccccc1 Amb28074660 [0,0,0,0,0,0|1,0,1]=2 97 B13R1.42 C\C=C\C(O)\C=C\c1ccccc1 Amb28079231 [0,0,0,0,0,0|1,0,3]=4 98 B13R1.42 N#CCC(=O)\C=C\c1ccccc1 Amb27759542 [0,0,0,0,0,0|2,0,1]=3 99 B13R1.42 NC(\C=C\c1ccccc1)CCO Amb32954745 [0,0,0,0,0,0|3,0,1]=4 100 B13R1.42 NCCC(=O)NCc1ccccc1 Amb15740949 [0,0,0,0,0,0|3,0,1]=4 101 B13R1.42 NCCC(=O)NCc1ccccc1 Amb5784981 [0,0,0,0,0,0|3,0,1]=4 102 B13R1.42 NCCC(=O)OCc1ccccc1 Amb33549621 [0,0,0,0,0,0|3,0,1]=4 103 B13R1.42 NCCC(=O)OCc1ccccc1 Amb6740279 [0,0,0,0,0,0|3,0,1]=4 104 B13R1.42 NCCC(=O)\C=C\c1ccccc1 Amb33081763 [0,0,0,0,0,0|2,0,0]=2 105 B13R1.42 NCCC(F)\C=C\c1ccccc1 Amb33081748 [0,0,0,0,0,0|3,0,1]=4 106 B13R1.42 NCCC(O)\C=C\c1ccccc1 Amb33081221 [0,0,0,0,0,0|2,0,2]=4 107 B13R1.42 NCC[C@@H](O)\C=C\c1ccccc1 Amb33080768 [0,0,0,0,0,0|2,0,2]=4 108 B13R1.42 NCC[C@H](O)\C=C\c1ccccc1 Amb33080769 [0,0,0,0,0,0|2,0,2]=4 109 B13R1.42 NCNC(=O)OCc1ccccc1 Amb27983552 [0,0,0,0,0,0|3,0,1]=4 110 B13R1.42 N\C=C\C(=O)\C=C\c1ccccc1 Amb28385592 [0,0,0,0,0,0|2,0,1]=3 111 B13R1.42 O=C(CCBr)OCc1ccccc1 Amb22232000 [0,0,0,0,0,0|3,0,1]=4 112 B13R1.42 O=C(CCCl)NCc1ccccc1 Amb1931859 [0,0,0,0,0,0|3,0,1]=4 113 B13R1.42 O=C(CCCl)OCc1ccccc1 Amb26951432 [0,0,0,0,0,0|3,0,1]=4 114 B13R1.42 O=C(CCF)OCc1ccccc1 Amb22497154 [0,0,0,0,0,0|3,0,1]=4 115 B13R1.42 O=C(CCO)NCc1ccccc1 Amb17335299 [0,0,0,0,0,0|3,0,1]=4 116 B13R1.42 O=C(CCO)NNc1ccccc1 Amb27180414 [0,0,0,0,0,0|4,0,0]=4 117 B13R1.42 O=C(CCO)OCc1ccccc1 Amb17609079 [0,0,0,0,0,0|3,0,1]=4 118 B13R1.42 O=C(CCS)NCc1ccccc1 Amb27947419 [0,0,0,0,0,0|3,0,1]=4 119 B13R1.42 O=C(CCS)OCc1ccccc1 Amb24495479 [0,0,0,0,0,0|3,0,1]=4 120 B13R1.42 O=C(NCO)OCc1ccccc1 Amb10066979 [0,0,0,0,0,0|3,0,1]=4 121 B13R1.42 O=C(\C=C/O)\C=C\c1ccccc1 Amb27750264 [0,0,0,0,0,0|2,0,1]=3 122 B13R1.42 O=C(\C=C\c1ccccc1)N=C=S Amb2686558 [0,0,0,0,0,0|2,0,1]=3 123 B13R1.42 O=C(\C=C\c1ccccc1)\C=N\O Amb25065153 [0,0,0,0,0,0|3,0,0]=3 124 B13R1.42 O=C=NC(=S)\C=C\c1ccccc1 Amb27238559 [0,0,0,0,0,0|2,1,1]=4 125 B13R1.42 O=C\C=C(Cl)\C=C\c1ccccc1 Amb27643648 [0,0,0,0,0,0|3,0,1]=4 126 B13R1.42 [N-]=[N+]=CC(=O)\C=C\c1ccccc1 Amb20248597 [0,0,0,0,0,0|3,0,0]=3 127 B12R1.8 BrCCC\C=C\c1ccccc1 Amb33081215 [1,0,0,0,0,0|2,0,1]=4 128 B12R1.8 BrC\C=C\C=C\c1ccccc1 Amb8394285 [1,0,0,0,0,0|2,0,0]=3 129 B12R1.8 CCCC\C=C/c1ccccc1 Amb22546625 [1,0,0,0,0,0|1,0,1]=3 130 B12R1.8 CCCC\C=C\c1ccccn1 Amb19148732 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.8 CCC\C=C/Cc1ccccc1 Amb22546636 [1,0,0,0,0,0|1,0,1]=3 132 B12R1.8 CCNC\C=C\c1ccccc1 Amb6864716 [1,0,0,0,0,0|1,0,1]=3 133 B12R1.8 CCNC\C=C\c1ccccc1 Amb837817 [1,0,0,0,0,0|1,0,1]=3 134 B12R1.8 CCOCOCc1ccccc1 Amb27830530 [1,0,0,0,0,0|1,0,2]=4 135 B12R1.8 CNCC\C=C\c1ccccc1 Amb32954379 [1,0,0,0,0,0|2,0,1]=4 136 B12R1.8 CO\N=C\C=C\c1ccccc1 Amb27396673 [1,0,0,0,0,0|2,0,0]=3 137 B12R1.8 CO\N=C\C=C\c1ccncc1 Amb27809416 [1,0,0,0,0,0|3,0,0]=4 138 B12R1.8 NCCC\C=C\c1ccccc1 Amb18563531 [1,0,0,0,0,0|2,0,1]=4 139 B12R1.8 NC\C=C\C=C\c1ccccc1 Amb32953332 [1,0,0,0,0,0|2,0,0]=3 140 B12R1.8 O=COC\C=C\c1ccccc1 Amb6357969 [1,0,0,0,0,0|1,0,2]=4 141 B12R1.8 O=C\C=C\C=C\c1ccccc1 Amb17593956 [1,0,0,0,0,0|2,0,1]=4 142 B12R1.8 OCC#C\C=C\c1ccccc1 Amb27977863 [1,0,0,0,0,0|2,0,1]=4 143 B12R1.8 OCCC=C=Cc1ccccc1 Amb27972290 [1,0,0,0,0,0|2,0,1]=4 144 B12R1.8 OCCC\C=C\c1ccccc1 Amb33082089 [1,0,0,0,0,0|2,0,1]=4 145 B12R1.8 OCCN\C=C\c1ccccc1 Amb25087866 [1,0,0,0,0,0|3,0,0]=4 146 B12R1.8 OC\C=C\C=C\c1ccccc1 Amb33081530 [1,0,0,0,0,0|2,0,0]=3 147 B12R1.8 SCCC\C=C\c1ccccc1 Amb33081102 [1,0,0,0,0,0|2,0,1]=4 148 B12R1.27 C=C(\C=C\c1ccccc1)CBr Amb33081080 [1,0,0,0,0,0|2,0,0]=3 149 B12R1.27 C=C(\C=C\c1ccccc1)CCl Amb33081096 [1,0,0,0,0,0|2,0,0]=3 150 B12R1.27 C=C(\C=C\c1ccccc1)CN Amb33080787 [1,0,0,0,0,0|2,0,0]=3 151 B12R1.27 C=CC(=O)\C=C\c1ccccc1 Amb33503118 [1,0,0,0,0,0|0,0,2]=3 152 B12R1.27 CC(\C=C\c1ccccc1)=N/O Amb24101081 [1,0,0,0,0,0|3,0,0]=4 153 B12R1.27 CC(\C=C\c1ccccc1)=N\O Amb27204245 [1,0,0,0,0,0|3,0,0]=4 154 B12R1.27 CC(\C=C\c1ccccc1)CBr Amb33080770 [1,0,0,0,0,0|2,0,1]=4 155 B12R1.27 CC(\C=C\c1ccccc1)CN Amb33081132 [1,0,0,0,0,0|2,0,1]=4 156 B12R1.27 CC(\C=C\c1ccccc1)ON Amb33080788 [1,0,0,0,0,0|2,0,1]=4 157 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [1,0,0,0,0,0|2,0,1]=4 158 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [1,0,0,0,0,0|0,0,2]=3 159 B12R1.27 CCC(=O)CCc1ccccc1 Amb3940674 [1,0,0,0,0,0|0,0,2]=3 160 B12R1.27 CCC(=O)CNc1ccccc1 Amb27643385 [1,0,0,0,0,0|1,0,1]=3 161 B12R1.27 CCC(=O)CSc1ccccc1 Amb4165963 [1,0,0,0,0,0|1,0,1]=3 162 B12R1.27 CCC(=O)NCc1ccccc1 Amb3097295 [1,0,0,0,0,0|1,0,1]=3 163 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [1,0,0,0,0,0|2,0,1]=4 164 B12R1.27 CCC(=O)NNc1ccccc1 Amb2720825 [1,0,0,0,0,0|2,0,0]=3 165 B12R1.27 CCC(=O)NNc1ccccn1 Amb27652531 [1,0,0,0,0,0|3,0,0]=4 166 B12R1.27 CCC(=O)NOc1ccccc1 Amb27827163 [1,0,0,0,0,0|2,0,0]=3 167 B12R1.27 CCC(=O)OCc1ccccc1 Amb6357157 [1,0,0,0,0,0|1,0,1]=3 168 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,0,0,0,0,0|0,0,0]=1 169 B12R1.27 CCC(=O)\C=C\c1ccncc1 Amb25962375 [1,0,0,0,0,0|1,0,0]=2 170 B12R1.27 CCC(=S)OCc1ccccc1 Amb28078330 [1,0,0,0,0,0|1,1,1]=4 171 B12R1.27 CCC(N)\C=C\c1cccnc1 Amb24526364 [1,0,0,0,0,0|2,0,1]=4 172 B12R1.27 CCC(O)\C=C\c1ccccc1 Amb22546605 [1,0,0,0,0,0|0,0,2]=3 173 B12R1.27 CCS(=O)\N=C\c1ccccc1 Amb35726562 [1,0,0,0,0,0|2,0,0]=3 174 B12R1.27 CCS(=O)\N=C\c1ccccn1 Amb35726556 [1,0,0,0,0,0|3,0,0]=4 175 B12R1.27 CCS(=O)\N=C\c1cccnc1 Amb35726558 [1,0,0,0,0,0|3,0,0]=4 176 B12R1.27 CCS(=O)\N=C\c1ccncc1 Amb35726600 [1,0,0,0,0,0|3,0,0]=4 177 B12R1.27 CC[C@H](O)\C=C\c1ccccc1 Amb27205385 [1,0,0,0,0,0|0,0,2]=3 178 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [1,0,0,0,0,0|1,0,2]=4 179 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [1,0,0,0,0,0|2,0,1]=4 180 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [1,0,0,0,0,0|3,0,0]=4 181 B12R1.27 CNC(=O)NOc1ccccc1 Amb27848154 [1,0,0,0,0,0|3,0,0]=4 182 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [1,0,0,0,0,0|2,0,1]=4 183 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [1,0,0,0,0,0|2,0,1]=4 184 B12R1.27 CNC(=O)\C=C\c1ccncc1 Amb28454984 [1,0,0,0,0,0|2,0,0]=3 185 B12R1.27 COC(=N)CSc1ccccc1 Amb29847972 [1,0,0,0,0,0|2,0,1]=4 186 B12R1.27 COC(=O)C#Cc1ccccc1 Amb4019367 [1,0,0,0,0,0|0,0,2]=3 187 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [1,0,0,0,0,0|1,0,2]=4 188 B12R1.27 COC(=O)C#Cc1cccnc1 Amb28122840 [1,0,0,0,0,0|1,0,2]=4 189 B12R1.27 COC(=O)C#Cc1ccncc1 Amb27227860 [1,0,0,0,0,0|1,0,2]=4 190 B12R1.27 COC(=O)CCc1ccccc1 Amb843216 [1,0,0,0,0,0|0,0,2]=3 191 B12R1.27 COC(=O)CCc1cccnc1 Amb6357821 [1,0,0,0,0,0|1,0,2]=4 192 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [1,0,0,0,0,0|1,0,2]=4 193 B12R1.27 COC(=O)CNc1ccccc1 Amb33548260 [1,0,0,0,0,0|1,0,1]=3 194 B12R1.27 COC(=O)CNc1ccccc1 Amb6323391 [1,0,0,0,0,0|1,0,1]=3 195 B12R1.27 COC(=O)CNc1ccccn1 Amb6649089 [1,0,0,0,0,0|2,0,1]=4 196 B12R1.27 COC(=O)CNc1cccnc1 Amb18270093 [1,0,0,0,0,0|2,0,1]=4 197 B12R1.27 COC(=O)CNc1ccncc1 Amb6631083 [1,0,0,0,0,0|2,0,1]=4 198 B12R1.27 COC(=O)COc1ccccc1 Amb2689596 [1,0,0,0,0,0|1,0,1]=3 199 B12R1.27 COC(=O)COc1ccccn1 Amb24095859 [1,0,0,0,0,0|2,0,1]=4 200 B12R1.27 COC(=O)CSc1ccccc1 Amb2689638 [1,0,0,0,0,0|1,0,1]=3 201 B12R1.27 COC(=O)NCc1ccccc1 Amb2746993 [1,0,0,0,0,0|1,0,1]=3 202 B12R1.27 COC(=O)NNc1ccccn1 Amb28350961 [1,0,0,0,0,0|3,0,0]=4 203 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [1,0,0,0,0,0|1,0,1]=3 204 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb33716217 [1,0,0,0,0,0|0,0,0]=1 205 B12R1.27 COC(=O)\C=C\c1ccccc1 Amb8515074 [1,0,0,0,0,0|0,0,0]=1 206 B12R1.27 COC(=O)\C=C\c1ccccn1 Amb25036096 [1,0,0,0,0,0|1,0,0]=2 207 B12R1.27 COC(=O)\C=C\c1cccnc1 Amb17844385 [1,0,0,0,0,0|1,0,0]=2 208 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb20668041 [1,0,0,0,0,0|1,0,0]=2 209 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb24074160 [1,0,0,0,0,0|1,0,0]=2 210 B12R1.27 COC(=O)\C=C\c1ccncn1 Amb28069217 [1,0,0,0,0,0|2,0,0]=3 211 B12R1.27 COC(=O)\C=C\c1cnccn1 Amb22524637 [1,0,0,0,0,0|2,0,0]=3 212 B12R1.27 COC(=O)\C=C\c1cncnc1 Amb2698637 [1,0,0,0,0,0|2,0,0]=3 213 B12R1.27 COC(=O)\C=C\c1ncccn1 Amb25337205 [1,0,0,0,0,0|2,0,0]=3 214 B12R1.27 COC(=S)NCc1ccccc1 Amb27388388 [1,0,0,0,0,0|1,1,1]=4 215 B12R1.27 COC(Cl)\C=C\c1ccccc1 Amb26371733 [1,0,0,0,0,0|1,0,1]=3 216 B12R1.27 C[C@@H](\C=C\c1ccccc1)CO Amb27642008 [1,0,0,0,0,0|2,0,1]=4 217 B12R1.27 C\C(=C/Cc1ccccc1)CN Amb27402545 [1,0,0,0,0,0|2,0,1]=4 218 B12R1.27 C\C(=C\Cc1ccccc1)CO Amb17594048 [1,0,0,0,0,0|2,0,1]=4 219 B12R1.27 ClCC(Cl)\C=C\c1ccccc1 Amb25124868 [1,0,0,0,0,0|2,0,1]=4 220 B12R1.27 NC(\C=C\c1ccccc1)=N/O Amb27816576 [1,0,0,0,0,0|3,0,0]=4 221 B12R1.27 NC(\C=C\c1ccccc1)=N\O Amb25065269 [1,0,0,0,0,0|3,0,0]=4 222 B12R1.27 NC(\C=C\c1ccccc1)CO Amb32954713 [1,0,0,0,0,0|2,0,1]=4 223 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [1,0,0,0,0,0|1,0,2]=4 224 B12R1.27 NCC(=O)CCc1ccccc1 Amb35788694 [1,0,0,0,0,0|1,0,2]=4 225 B12R1.27 NCC(=O)NCc1ccccc1 Amb6477742 [1,0,0,0,0,0|2,0,1]=4 226 B12R1.27 NCC(=O)NCc1ccccc1 Amb7969763 [1,0,0,0,0,0|2,0,1]=4 227 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [1,0,0,0,0,0|2,0,1]=4 228 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [1,0,0,0,0,0|2,0,1]=4 229 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb32954851 [1,0,0,0,0,0|1,0,0]=2 230 B12R1.27 NCC(Cl)\C=C\c1ccccc1 Amb27447294 [1,0,0,0,0,0|2,0,1]=4 231 B12R1.27 NCC(F)\C=C\c1ccccc1 Amb33081747 [1,0,0,0,0,0|2,0,1]=4 232 B12R1.27 NCC(O)\C=C\c1ccccc1 Amb32953205 [1,0,0,0,0,0|1,0,2]=4 233 B12R1.27 NC[C@@H](O)\C=C\c1ccccc1 Amb33080765 [1,0,0,0,0,0|1,0,2]=4 234 B12R1.27 NC[C@H](O)\C=C\c1ccccc1 Amb33080762 [1,0,0,0,0,0|1,0,2]=4 235 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb9817076 [1,0,0,0,0,0|2,0,0]=3 236 B12R1.27 NNC(=O)\C=C\c1cccnc1 Amb2612884 [1,0,0,0,0,0|3,0,0]=4 237 B12R1.27 NNC(=O)\C=C\c1ccncc1 Amb26611701 [1,0,0,0,0,0|3,0,0]=4 238 B12R1.27 N[C@@H](\C=C\c1ccccc1)CO Amb33081817 [1,0,0,0,0,0|2,0,1]=4 239 B12R1.27 N[C@H](\C=C\c1ccccc1)CO Amb32953226 [1,0,0,0,0,0|2,0,1]=4 240 B12R1.27 O=C(C#Cc1ccccc1)CCl Amb26866804 [1,0,0,0,0,0|1,0,2]=4 241 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [1,0,0,0,0,0|1,0,2]=4 242 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [1,0,0,0,0,0|2,0,1]=4 243 B12R1.27 O=C(CBr)NCc1ccccc1 Amb2221074 [1,0,0,0,0,0|2,0,1]=4 244 B12R1.27 O=C(CBr)OCc1ccccc1 Amb2720586 [1,0,0,0,0,0|2,0,1]=4 245 B12R1.27 O=C(CCl)CCc1ccccc1 Amb17139043 [1,0,0,0,0,0|1,0,2]=4 246 B12R1.27 O=C(CCl)COc1ccccc1 Amb17139095 [1,0,0,0,0,0|2,0,1]=4 247 B12R1.27 O=C(CCl)CSc1ccccc1 Amb32435047 [1,0,0,0,0,0|2,0,1]=4 248 B12R1.27 O=C(CCl)NCc1ccccc1 Amb6324481 [1,0,0,0,0,0|2,0,1]=4 249 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [1,0,0,0,0,0|3,0,0]=4 250 B12R1.27 O=C(CCl)OCc1ccccc1 Amb844249 [1,0,0,0,0,0|2,0,1]=4 251 B12R1.27 O=C(CF)NCc1ccccc1 Amb27237611 [1,0,0,0,0,0|2,0,1]=4 252 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [1,0,0,0,0,0|2,0,1]=4 253 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [1,0,0,0,0,0|2,0,1]=4 254 B12R1.27 O=C(CO)CCc1ccccc1 Amb18563609 [1,0,0,0,0,0|1,0,2]=4 255 B12R1.27 O=C(CO)COc1ccccc1 Amb18563713 [1,0,0,0,0,0|2,0,1]=4 256 B12R1.27 O=C(CO)NCc1ccccc1 Amb1111331 [1,0,0,0,0,0|2,0,1]=4 257 B12R1.27 O=C(CO)NNc1ccccc1 Amb27615381 [1,0,0,0,0,0|3,0,0]=4 258 B12R1.27 O=C(CO)OCc1ccccc1 Amb3939223 [1,0,0,0,0,0|2,0,1]=4 259 B12R1.27 O=C(CS)NNc1ccccc1 Amb8459004 [1,0,0,0,0,0|3,0,0]=4 260 B12R1.27 O=C(CS)OCc1ccccc1 Amb9786411 [1,0,0,0,0,0|2,0,1]=4 261 B12R1.27 O=C(\C=C\c1ccccc1)CBr Amb17596167 [1,0,0,0,0,0|1,0,0]=2 262 B12R1.27 O=C(\C=C\c1ccccc1)CCl Amb17594640 [1,0,0,0,0,0|1,0,0]=2 263 B12R1.27 O=C(\C=C\c1ccccc1)N[O-] Amb27185829 [1,0,0,0,0,0|2,0,0]=3 264 B12R1.27 O=C(\C=C\c1ccccn1)NO Amb28370532 [1,0,0,0,0,0|3,0,0]=4 265 B12R1.27 O=C(\C=C\c1cccnc1)NO Amb28140433 [1,0,0,0,0,0|3,0,0]=4 266 B12R1.27 OC(\C=C\c1ccccc1)CBr Amb33080783 [1,0,0,0,0,0|1,0,2]=4 267 B12R1.27 OC(\C=C\c1ccccc1)CCl Amb26527861 [1,0,0,0,0,0|1,0,2]=4 268 B12R1.27 OC(\C=C\c1ccccc1)CF Amb32953290 [1,0,0,0,0,0|1,0,2]=4 269 B12R1.27 OCC(F)\C=C\c1ccccc1 Amb27593937 [1,0,0,0,0,0|2,0,1]=4 270 B12R1.27 OCC(O)\C=C\c1ccccc1 Amb32953203 [1,0,0,0,0,0|1,0,2]=4 271 B12R1.27 OC[C@H](O)\C=C\c1ccccc1 Amb28410835 [1,0,0,0,0,0|1,0,2]=4 272 B12R1.27 [NH3+]CC(=O)OCc1ccccc1 Amb4037912 [1,0,0,0,0,0|2,0,1]=4 273 B14R1.29 C=C(NC(=O)CCC)c1ccccc1 Amb28251178 [0,1,0,0,0,0|2,0,0]=3 274 B14R1.29 C=C(NC(=O)OCC)c1ccccc1 Amb27230566 [0,1,0,0,0,0|1,0,0]=2 275 B14R1.29 CCCC(=O)CC(=O)c1ccccc1 Amb17940804 [0,1,0,0,0,0|1,0,1]=3 276 B14R1.29 CCCC(=O)CC(=O)c1ccccn1 Amb19041153 [0,1,0,0,0,0|2,0,1]=4 277 B14R1.29 CCCC(=O)CC(=O)c1cccnc1 Amb19041154 [0,1,0,0,0,0|2,0,1]=4 278 B14R1.29 CCCC(=O)CC(=O)c1ccncc1 Amb19041155 [0,1,0,0,0,0|2,0,1]=4 279 B14R1.29 CCNC(=O)CC(N)c1ccccc1 Amb6280643 [0,1,0,0,0,0|1,0,2]=4 280 B14R1.29 CCNC(=O)NC(=O)c1cccnc1 Amb25723374 [0,1,0,0,0,0|3,0,0]=4 281 B14R1.29 CCNC(=O)NN(C)c1ccccc1 Amb24336746 [0,1,0,0,0,0|3,0,0]=4 282 B14R1.29 CCNC(=O)N[C@@H](C)c1ccccc1 Amb27827991 [0,1,0,0,0,0|2,0,1]=4 283 B14R1.29 CCNC(=O)N[C@H](C)c1ccccc1 Amb28325812 [0,1,0,0,0,0|2,0,1]=4 284 B14R1.29 CCNC(=O)\C=C(\C)c1ccccc1 Amb27792973 [0,1,0,0,0,0|1,0,0]=2 285 B14R1.29 CCNC(=O)\C=C(\Cl)c1ccccc1 Amb27875186 [0,1,0,0,0,0|1,0,0]=2 286 B14R1.29 CCNC(=O)\C=C(\S)c1ccccc1 Amb27162822 [0,1,0,0,0,0|1,0,0]=2 287 B14R1.29 CCNC(=S)NC(=O)c1ccccc1 Amb4383204 [0,1,0,0,0,0|2,1,0]=4 288 B14R1.29 CCOC(=O)CC(=O)c1ccccc1 Amb1212681 [0,1,0,0,0,0|0,0,1]=2 289 B14R1.29 CCOC(=O)CC(=O)c1ccccn1 Amb13951245 [0,1,0,0,0,0|1,0,1]=3 290 B14R1.29 CCOC(=O)CC(=O)c1ccccn1 Amb33528912 [0,1,0,0,0,0|1,0,1]=3 291 B14R1.29 CCOC(=O)CC(=O)c1cccnc1 Amb1647670 [0,1,0,0,0,0|1,0,1]=3 292 B14R1.29 CCOC(=O)CC(=O)c1cccnc1 Amb6891797 [0,1,0,0,0,0|1,0,1]=3 293 B14R1.29 CCOC(=O)CC(=O)c1ccncc1 Amb33528914 [0,1,0,0,0,0|1,0,1]=3 294 B14R1.29 CCOC(=O)CC(=O)c1ccncn1 Amb22170381 [0,1,0,0,0,0|2,0,1]=4 295 B14R1.29 CCOC(=O)CC(=O)c1cnccn1 Amb17935775 [0,1,0,0,0,0|2,0,1]=4 296 B14R1.29 CCOC(=O)CC(=O)c1ncccn1 Amb19062435 [0,1,0,0,0,0|2,0,1]=4 297 B14R1.29 CCOC(=O)CC(N)c1ccccc1 Amb4246797 [0,1,0,0,0,0|0,0,2]=3 298 B14R1.29 CCOC(=O)CC(N)c1ccccc1 Amb595536 [0,1,0,0,0,0|0,0,2]=3 299 B14R1.29 CCOC(=O)CC(N)c1ccccn1 Amb7800582 [0,1,0,0,0,0|1,0,2]=4 300 B14R1.29 CCOC(=O)CC(N)c1cccnc1 Amb22496800 [0,1,0,0,0,0|1,0,2]=4 301 B14R1.29 CCOC(=O)CC(N)c1cccnc1 Amb2697507 [0,1,0,0,0,0|1,0,2]=4 302 B14R1.29 CCOC(=O)CC(N)c1ccncc1 Amb22495263 [0,1,0,0,0,0|1,0,2]=4 303 B14R1.29 CCOC(=O)CC(N)c1ccncc1 Amb7800559 [0,1,0,0,0,0|1,0,2]=4 304 B14R1.29 CCOC(=O)CC(O)c1ccccc1 Amb4017744 [0,1,0,0,0,0|0,0,2]=3 305 B14R1.29 CCOC(=O)CC(O)c1cccnc1 Amb9704295 [0,1,0,0,0,0|1,0,2]=4 306 B14R1.29 CCOC(=O)CC([NH3+])c1ccccc1 Amb5722513 [0,1,0,0,0,0|0,0,2]=3 307 B14R1.29 CCOC(=O)CN(C)c1ccccn1 Amb19042528 [0,1,0,0,0,0|2,0,1]=4 308 B14R1.29 CCOC(=O)C[C@@H](N)c1ccccc1 Amb19051013 [0,1,0,0,0,0|0,0,2]=3 309 B14R1.29 CCOC(=O)C[C@@H](N)c1ccccc1 Amb8516393 [0,1,0,0,0,0|0,0,2]=3 310 B14R1.29 CCOC(=O)C[C@@H](N)c1cccnc1 Amb19051578 [0,1,0,0,0,0|1,0,2]=4 311 B14R1.29 CCOC(=O)C[C@@H](N)c1cccnc1 Amb8631181 [0,1,0,0,0,0|1,0,2]=4 312 B14R1.29 CCOC(=O)C[C@@H](O)c1ccccc1 Amb10070415 [0,1,0,0,0,0|0,0,2]=3 313 B14R1.29 CCOC(=O)C[C@H](N)c1ccccc1 Amb6365658 [0,1,0,0,0,0|0,0,2]=3 314 B14R1.29 CCOC(=O)C[C@H](N)c1cccnc1 Amb19887623 [0,1,0,0,0,0|1,0,2]=4 315 B14R1.29 CCOC(=O)C[C@H](N)c1cccnc1 Amb35788621 [0,1,0,0,0,0|1,0,2]=4 316 B14R1.29 CCOC(=O)C[C@H](O)c1ccccc1 Amb6356330 [0,1,0,0,0,0|0,0,2]=3 317 B14R1.29 CCOC(=O)NC(=N)c1ccccc1 Amb4057355 [0,1,0,0,0,0|1,0,0]=2 318 B14R1.29 CCOC(=O)NC(=O)c1ccccc1 Amb2682787 [0,1,0,0,0,0|1,0,0]=2 319 B14R1.29 CCOC(=O)NC(=S)c1cccnc1 Amb10559604 [0,1,0,0,0,0|2,0,0]=3 320 B14R1.29 CCOC(=O)\C=C(/C)c1ccccc1 Amb8391067 [0,1,0,0,0,0|0,0,0]=1 321 B14R1.29 CCOC(=O)\C=C(/N)c1ccccn1 Amb34912764 [0,1,0,0,0,0|1,0,0]=2 322 B14R1.29 CCOC(=O)\C=C(\C)c1ccccc1 Amb10566527 [0,1,0,0,0,0|0,0,0]=1 323 B14R1.29 CCOC(=O)\C=C(\C)c1ccccn1 Amb33493051 [0,1,0,0,0,0|1,0,0]=2 324 B14R1.29 CCOC(=O)\C=C(\C)c1cccnc1 Amb33493054 [0,1,0,0,0,0|1,0,0]=2 325 B14R1.29 CCOC(=O)\C=C(\C)c1ccncc1 Amb33493053 [0,1,0,0,0,0|1,0,0]=2 326 B14R1.29 CCOC(=O)\C=C(\C)c1cnccn1 Amb33493147 [0,1,0,0,0,0|2,0,0]=3 327 B14R1.29 CCOC(=S)NC(=O)c1ccccc1 Amb1641309 [0,1,0,0,0,0|1,1,0]=3 328 B14R1.29 CCSC(=S)NC(=O)c1ccccc1 Amb27957519 [0,1,0,0,0,0|1,2,0]=4 329 B14R1.29 COCC(=O)CC(=O)c1ccccc1 Amb33291406 [0,1,0,0,0,0|2,0,1]=4 330 B14R1.29 C\C(=C/C(=O)N=[N+]=[N-])c1ccccc1 Amb27864054 [0,1,0,0,0,0|3,0,0]=4 331 B14R1.29 C\C=C\C(=O)NC(=O)c1ccccc1 Amb25964354 [0,1,0,0,0,0|2,0,1]=4 332 B14R1.29 N\C(=C/C(=O)NC=O)c1ccccc1 Amb28145844 [0,1,0,0,0,0|2,0,1]=4 333 B14R1.29 [N-]=[N+]=NC(=O)\C=C(/Cl)c1ccccc1 Amb28285564 [0,1,0,0,0,0|3,0,0]=4 334 B14R1.32 CCCC(=O)CSc1cccc(Br)c1 Amb32683086 [0,1,0,0,0,0|2,0,1]=4 335 B14R1.32 CCCC(=O)CSc1cccc(C)c1 Amb32683103 [0,1,0,0,0,0|2,0,1]=4 336 B14R1.32 CCCC(=O)CSc1cccc(Cl)c1 Amb32683094 [0,1,0,0,0,0|2,0,1]=4 337 B14R1.32 CCCC(=O)CSc1cccc(F)c1 Amb32683098 [0,1,0,0,0,0|2,0,1]=4 338 B14R1.32 CCNC(=O)CCc1cccc(N)c1 Amb8941584 [0,1,0,0,0,0|1,0,2]=4 339 B14R1.32 CCNC(=O)COc1cccc(Br)c1 Amb6265692 [0,1,0,0,0,0|2,0,1]=4 340 B14R1.32 CCNC(=O)COc1cccc(N)c1 Amb33545769 [0,1,0,0,0,0|2,0,1]=4 341 B14R1.32 CCNC(=O)NCc1cccc(Br)c1 Amb24687856 [0,1,0,0,0,0|2,0,1]=4 342 B14R1.32 CCNC(=O)NCc1cccc(Cl)c1 Amb158950 [0,1,0,0,0,0|2,0,1]=4 343 B14R1.32 CCNC(=O)NCc1cccc(O)c1 Amb19051553 [0,1,0,0,0,0|2,0,1]=4 344 B14R1.32 CCNC(=O)NNc1cccc(C)c1 Amb28070921 [0,1,0,0,0,0|3,0,0]=4 345 B14R1.32 CCNC(=O)\C=C\c1cccc(Br)c1 Amb9786534 [0,1,0,0,0,0|1,0,0]=2 346 B14R1.32 CCNC(=O)\C=C\c1cccc(C)c1 Amb28364222 [0,1,0,0,0,0|1,0,0]=2 347 B14R1.32 CCNC(=O)\C=C\c1cccc(N)c1 Amb17139254 [0,1,0,0,0,0|1,0,0]=2 348 B14R1.32 CCOC(=N)COc1cccc(C)c1 Amb24103554 [0,1,0,0,0,0|2,0,1]=4 349 B14R1.32 CCOC(=N)COc1cccc(F)c1 Amb24103552 [0,1,0,0,0,0|2,0,1]=4 350 B14R1.32 CCOC(=O)C#Cc1cccc(Br)c1 Amb27603325 [0,1,0,0,0,0|0,0,2]=3 351 B14R1.32 CCOC(=O)C#Cc1cccc(C)c1 Amb24450274 [0,1,0,0,0,0|0,0,2]=3 352 B14R1.32 CCOC(=O)C#Cc1cccc(Cl)c1 Amb24093911 [0,1,0,0,0,0|0,0,2]=3 353 B14R1.32 CCOC(=O)C#Cc1cccc(F)c1 Amb24063534 [0,1,0,0,0,0|0,0,2]=3 354 B14R1.32 CCOC(=O)C#Cc1cccc(N)c1 Amb25088348 [0,1,0,0,0,0|0,0,2]=3 355 B14R1.32 CCOC(=O)C#Cc1cccc(O)c1 Amb25814600 [0,1,0,0,0,0|0,0,2]=3 356 B14R1.32 CCOC(=O)C#Cc1ccnc(C)c1 Amb24383515 [0,1,0,0,0,0|1,0,2]=4 357 B14R1.32 CCOC(=O)C#Cc1cncc(F)c1 Amb27585740 [0,1,0,0,0,0|1,0,2]=4 358 B14R1.32 CCOC(=O)CCc1cccc(Br)c1 Amb22232484 [0,1,0,0,0,0|0,0,2]=3 359 B14R1.32 CCOC(=O)CCc1cccc(C)c1 Amb19073886 [0,1,0,0,0,0|0,0,2]=3 360 B14R1.32 CCOC(=O)CCc1cccc(Cl)c1 Amb34130702 [0,1,0,0,0,0|0,0,2]=3 361 B14R1.32 CCOC(=O)CCc1cccc(N)c1 Amb22396481 [0,1,0,0,0,0|0,0,2]=3 362 B14R1.32 CCOC(=O)CCc1cccc(N)c1 Amb33623730 [0,1,0,0,0,0|0,0,2]=3 363 B14R1.32 CCOC(=O)CCc1cccc(O)c1 Amb19515925 [0,1,0,0,0,0|0,0,2]=3 364 B14R1.32 CCOC(=O)CCc1cncc(N)c1 Amb24105491 [0,1,0,0,0,0|1,0,2]=4 365 B14R1.32 CCOC(=O)CNc1cc(N)ccn1 Amb19063355 [0,1,0,0,0,0|2,0,1]=4 366 B14R1.32 CCOC(=O)CNc1cccc(Br)c1 Amb6712281 [0,1,0,0,0,0|1,0,1]=3 367 B14R1.32 CCOC(=O)CNc1cccc(C)c1 Amb6706759 [0,1,0,0,0,0|1,0,1]=3 368 B14R1.32 CCOC(=O)CNc1cccc(C)n1 Amb19051523 [0,1,0,0,0,0|2,0,1]=4 369 B14R1.32 CCOC(=O)CNc1cccc(Cl)c1 Amb4086541 [0,1,0,0,0,0|1,0,1]=3 370 B14R1.32 CCOC(=O)CNc1cccc(F)c1 Amb6711936 [0,1,0,0,0,0|1,0,1]=3 371 B14R1.32 CCOC(=O)CNc1cccc(F)n1 Amb19044816 [0,1,0,0,0,0|2,0,1]=4 372 B14R1.32 CCOC(=O)COc1cc(Cl)ccn1 Amb2610132 [0,1,0,0,0,0|2,0,1]=4 373 B14R1.32 CCOC(=O)COc1cccc(Br)c1 Amb6548212 [0,1,0,0,0,0|1,0,1]=3 374 B14R1.32 CCOC(=O)COc1cccc(C)n1 Amb23590347 [0,1,0,0,0,0|2,0,1]=4 375 B14R1.32 CCOC(=O)COc1cccc(Cl)c1 Amb2574396 [0,1,0,0,0,0|1,0,1]=3 376 B14R1.32 CCOC(=O)COc1cccc(F)c1 Amb7755237 [0,1,0,0,0,0|1,0,1]=3 377 B14R1.32 CCOC(=O)COc1cccc(I)c1 Amb8830746 [0,1,0,0,0,0|1,0,1]=3 378 B14R1.32 CCOC(=O)COc1cccc(N)c1 Amb1119292 [0,1,0,0,0,0|1,0,1]=3 379 B14R1.32 CCOC(=O)CSc1cc(Cl)ccn1 Amb22301622 [0,1,0,0,0,0|2,0,1]=4 380 B14R1.32 CCOC(=O)CSc1cccc(Br)c1 Amb30588432 [0,1,0,0,0,0|1,0,1]=3 381 B14R1.32 CCOC(=O)CSc1cccc(Br)n1 Amb33328844 [0,1,0,0,0,0|2,0,1]=4 382 B14R1.32 CCOC(=O)CSc1cccc(N)c1 Amb30622814 [0,1,0,0,0,0|1,0,1]=3 383 B14R1.32 CCOC(=O)CSc1cncc(Br)c1 Amb33276133 [0,1,0,0,0,0|2,0,1]=4 384 B14R1.32 CCOC(=O)CSc1cncc(C)c1 Amb33276313 [0,1,0,0,0,0|2,0,1]=4 385 B14R1.32 CCOC(=O)\C=C\c1cc(Cl)ccn1 Amb33469204 [0,1,0,0,0,0|1,0,0]=2 386 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)c1 Amb23504994 [0,1,0,0,0,0|0,0,0]=1 387 B14R1.32 CCOC(=O)\C=C\c1cccc(Br)n1 Amb33469169 [0,1,0,0,0,0|1,0,0]=2 388 B14R1.32 CCOC(=O)\C=C\c1cccc(C)c1 Amb10566723 [0,1,0,0,0,0|0,0,0]=1 389 B14R1.32 CCOC(=O)\C=C\c1cccc(Cl)c1 Amb23504715 [0,1,0,0,0,0|0,0,0]=1 390 B14R1.32 CCOC(=O)\C=C\c1cccc(F)c1 Amb2699676 [0,1,0,0,0,0|0,0,0]=1 391 B14R1.32 CCOC(=O)\C=C\c1cccc(N)c1 Amb24061861 [0,1,0,0,0,0|0,0,0]=1 392 B14R1.32 CCOC(=O)\C=C\c1cccc(O)c1 Amb18651075 [0,1,0,0,0,0|0,0,0]=1 393 B14R1.32 CCOC(=O)\C=C\c1ccnc(Cl)c1 Amb6565042 [0,1,0,0,0,0|1,0,0]=2 394 B14R1.32 CCOC(=O)\C=C\c1cncc(Br)c1 Amb33469185 [0,1,0,0,0,0|1,0,0]=2 395 B14R1.32 CONC(=O)\C=C\c1cccc(C)c1 Amb27772238 [0,1,0,0,0,0|2,0,0]=3 396 B14R1.32 CONC(=O)\C=C\c1cccc(F)c1 Amb27611726 [0,1,0,0,0,0|2,0,0]=3 397 B14R1.32 Cc1cccc(\C=C\C(=O)N=[N+]=[N-])c1 Amb25288232 [0,1,0,0,0,0|3,0,0]=4 398 B14R1.32 N#CNC(=O)\C=C\c1cccc(Cl)c1 Amb27425470 [0,1,0,0,0,0|2,0,1]=4 399 B14R1.32 N#CNC(=O)\C=C\c1cccc(F)c1 Amb27586816 [0,1,0,0,0,0|2,0,1]=4 400 B14R1.32 [N-]=[N+]=NC(=O)\C=C\c1cccc(Cl)c1 Amb24366106 [0,1,0,0,0,0|3,0,0]=4 401 B14R1.32 [N-]=[N+]=NC(=O)\C=C\c1cccc(F)c1 Amb22551093 [0,1,0,0,0,0|3,0,0]=4 402 B14R1.60 C=C(CCN)\C(C)=C\c1ccccc1 Amb33381243 [0,1,0,0,0,0|3,0,0]=4 403 B14R1.60 C=C(SCC)C(=O)Nc1ccccc1 Amb28120049 [0,1,0,0,0,0|2,1,0]=4 404 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 Amb17401495 [0,1,0,0,0,0|1,0,1]=3 405 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 Amb1814008 [0,1,0,0,0,0|2,0,0]=3 406 B14R1.60 CCNC(=O)C(N)Cc1ccccc1 Amb6272689 [0,1,0,0,0,0|1,0,2]=4 407 B14R1.60 CCNC(=O)C(O)Cc1ccccc1 Amb32663008 [0,1,0,0,0,0|1,0,2]=4 408 B14R1.60 CCNC(=O)N(C)Cc1ccccc1 Amb3992988 [0,1,0,0,0,0|2,0,1]=4 409 B14R1.60 CCNC(=O)N(N)Cc1ccccc1 Amb27827787 [0,1,0,0,0,0|2,0,1]=4 410 B14R1.60 CCNC(=O)[C@@H](N)Cc1ccccc1 Amb17235472 [0,1,0,0,0,0|1,0,2]=4 411 B14R1.60 CCNC(=O)[C@@H](O)Cc1ccccc1 Amb32663961 [0,1,0,0,0,0|1,0,2]=4 412 B14R1.60 CCOC(=N)C(=S)Nc1ccccc1 Amb28185834 [0,1,0,0,0,0|2,0,0]=3 413 B14R1.60 CCOC(=O)C(=O)C[n+]1ccccc1 Amb32456074 [0,1,0,0,0,0|1,0,1]=3 414 B14R1.60 CCOC(=O)C(=O)Cc1ccccc1 Amb28989403 [0,1,0,0,0,0|0,0,1]=2 415 B14R1.60 CCOC(=O)C(=O)Cc1ccncc1 Amb9201724 [0,1,0,0,0,0|1,0,1]=3 416 B14R1.60 CCOC(=O)C(=O)Cc1cnccn1 Amb33719344 [0,1,0,0,0,0|2,0,1]=4 417 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 Amb1196006 [0,1,0,0,0,0|1,0,0]=2 418 B14R1.60 CCOC(=O)C(=O)Nc1ccccn1 Amb3886949 [0,1,0,0,0,0|2,0,0]=3 419 B14R1.60 CCOC(=O)C(=O)Nc1cccnc1 Amb3886946 [0,1,0,0,0,0|2,0,0]=3 420 B14R1.60 CCOC(=O)C(=O)Nc1cccnn1 Amb27183056 [0,1,0,0,0,0|3,0,0]=4 421 B14R1.60 CCOC(=O)C(=O)Nc1ccncc1 Amb5794362 [0,1,0,0,0,0|2,0,0]=3 422 B14R1.60 CCOC(=O)C(=O)Nc1ncccn1 Amb17048324 [0,1,0,0,0,0|3,0,0]=4 423 B14R1.60 CCOC(=O)C(=O)Oc1ccccn1 Amb24103622 [0,1,0,0,0,0|2,0,0]=3 424 B14R1.60 CCOC(=O)C(Br)Cc1ccccc1 Amb2794053 [0,1,0,0,0,0|0,0,2]=3 425 B14R1.60 CCOC(=O)C(C)Oc1ccccn1 Amb24065229 [0,1,0,0,0,0|2,0,1]=4 426 B14R1.60 CCOC(=O)C(F)Sc1ccccc1 Amb17940943 [0,1,0,0,0,0|1,0,1]=3 427 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb6334959 [0,1,0,0,0,0|0,0,2]=3 428 B14R1.60 CCOC(=O)C(N)Cc1ccccc1 Amb7762211 [0,1,0,0,0,0|0,0,2]=3 429 B14R1.60 CCOC(=O)C(N)Cc1ccccn1 Amb22498620 [0,1,0,0,0,0|1,0,2]=4 430 B14R1.60 CCOC(=O)C(N)Cc1ccccn1 Amb3788557 [0,1,0,0,0,0|1,0,2]=4 431 B14R1.60 CCOC(=O)C(N)Cc1cccnc1 Amb3788558 [0,1,0,0,0,0|1,0,2]=4 432 B14R1.60 CCOC(=O)C(N)Cc1ccncc1 Amb20622578 [0,1,0,0,0,0|1,0,2]=4 433 B14R1.60 CCOC(=O)C(N)Cc1ccncc1 Amb3788559 [0,1,0,0,0,0|1,0,2]=4 434 B14R1.60 CCOC(=O)C(O)Cc1ccccc1 Amb19079971 [0,1,0,0,0,0|0,0,2]=3 435 B14R1.60 CCOC(=O)C(O)Nc1ccccn1 Amb24095646 [0,1,0,0,0,0|2,0,1]=4 436 B14R1.60 CCOC(=O)N(C)Cc1ccccc1 Amb3095224 [0,1,0,0,0,0|1,0,1]=3 437 B14R1.60 CCOC(=O)N(O)Cc1ccccc1 Amb28248736 [0,1,0,0,0,0|1,0,1]=3 438 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb10844617 [0,1,0,0,0,0|0,0,2]=3 439 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccccc1 Amb2725501 [0,1,0,0,0,0|0,0,2]=3 440 B14R1.60 CCOC(=O)[C@@H](N)Cc1ccncc1 Amb33804700 [0,1,0,0,0,0|1,0,2]=4 441 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb19889827 [0,1,0,0,0,0|0,0,2]=3 442 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb3940062 [0,1,0,0,0,0|0,0,2]=3 443 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccn1 Amb33804617 [0,1,0,0,0,0|1,0,2]=4 444 B14R1.60 CCOC(=O)\C(C)=C\c1ccccn1 Amb32664894 [0,1,0,0,0,0|1,0,0]=2 445 B14R1.60 CCOC(=O)\C(C)=C\c1cccnc1 Amb32664895 [0,1,0,0,0,0|1,0,0]=2 446 B14R1.60 CCOC(=O)\C(Cl)=C\c1ccccc1 Amb32425173 [0,1,0,0,0,0|0,0,0]=1 447 B14R1.60 CCOC(=O)\C([O-])=C\c1ccncc1 Amb19506687 [0,1,0,0,0,0|1,0,0]=2 448 B14R1.60 CCOC(C)C(=O)Nc1ccccc1 Amb25992059 [0,1,0,0,0,0|2,0,1]=4 449 B14R1.60 CNCC(=O)\C(C)=C\c1ccccc1 Amb33476419 [0,1,0,0,0,0|2,0,0]=3 450 B14R1.60 C\C(=C/c1ccccc1)C(=O)CCN Amb33476404 [0,1,0,0,0,0|2,0,0]=3 451 B14R1.60 C\C(=C/c1ccccc1)C(=O)N=[N+]=[N-] Amb27876099 [0,1,0,0,0,0|3,0,0]=4 452 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/N Amb27858691 [0,1,0,0,0,0|2,0,1]=4 453 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C/[O-] Amb22728792 [0,1,0,0,0,0|2,0,1]=4 454 B14R1.60 C\C(=C/c1ccccc1)C(=O)\C=C\[O-] Amb24090361 [0,1,0,0,0,0|2,0,1]=4 455 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\N Amb28137904 [0,1,0,0,0,0|2,0,1]=4 456 B14R1.60 C\C(=C\c1ccccc1)C(=O)\C=C\O Amb27197219 [0,1,0,0,0,0|2,0,1]=4 457 B14R1.60 C\C=C\C(=O)C(=O)Nc1ccccc1 Amb26904574 [0,1,0,0,0,0|2,0,1]=4 458 B14R1.156 C#CCOC(=O)NCc1ccccc1 Amb8388819 [0,1,0,0,0,0|1,0,2]=4 459 B14R1.156 C=CCOC(=O)NCc1ccccc1 Amb26382880 [0,1,0,0,0,0|1,0,2]=4 460 B14R1.156 C=CCOC(=O)OCc1ccccc1 Amb27145426 [0,1,0,0,0,0|1,0,2]=4 461 B14R1.156 C=CCOC(=O)\C=C\c1ccccc1 Amb6358001 [0,1,0,0,0,0|0,0,1]=2 462 B14R1.156 CCCCC(=O)NCc1ccccc1 Amb3363781 [0,1,0,0,0,0|2,0,1]=4 463 B14R1.156 CCCNC(=O)CSc1ccccc1 Amb93776 [0,1,0,0,0,0|2,0,1]=4 464 B14R1.156 CCCNC(=O)NCc1ccccc1 Amb2236970 [0,1,0,0,0,0|2,0,1]=4 465 B14R1.156 CCCNC(=O)NNc1ccccc1 Amb27189074 [0,1,0,0,0,0|3,0,0]=4 466 B14R1.156 CCCOC(=O)NCc1ccccc1 Amb3101958 [0,1,0,0,0,0|1,0,1]=3 467 B14R1.156 CCCOC(=O)OCc1ccccc1 Amb27976572 [0,1,0,0,0,0|1,0,1]=3 468 B14R1.156 CCNCC(=O)C#Cc1ccccc1 Amb28142910 [0,1,0,0,0,0|1,0,2]=4 469 B14R1.156 CCNCC(=O)OCc1ccccc1 Amb19079330 [0,1,0,0,0,0|2,0,1]=4 470 B14R1.156 CCOCC(=O)C#Cc1ccccc1 Amb27829374 [0,1,0,0,0,0|0,0,2]=3 471 B14R1.156 CCOCC(=O)NCc1ccccn1 Amb2662090 [0,1,0,0,0,0|2,0,1]=4 472 B14R1.156 CCONC(=N)NCc1ccccc1 Amb27868374 [0,1,0,0,0,0|2,0,1]=4 473 B14R1.156 CCONC(=O)NCc1ccccc1 Amb27590818 [0,1,0,0,0,0|1,0,1]=3 474 B14R1.156 CCSCC(=O)NCc1ccccc1 Amb28076986 [0,1,0,0,0,0|1,1,1]=4 475 B14R1.156 CNCCC(=O)NCc1ccccc1 Amb19073978 [0,1,0,0,0,0|2,0,1]=4 476 B14R1.156 CNCCC(=O)OCc1ccccc1 Amb19061708 [0,1,0,0,0,0|2,0,1]=4 477 B14R1.156 CNCCC(=O)OCc1ccccc1 Amb33330108 [0,1,0,0,0,0|2,0,1]=4 478 B14R1.156 COCCC(=O)NCc1ccccc1 Amb28384929 [0,1,0,0,0,0|2,0,1]=4 479 B14R1.156 COCNC(=O)OCc1ccccc1 Amb26316850 [0,1,0,0,0,0|2,0,1]=4 480 B14R1.156 CSCCC(=O)NCc1ccccc1 Amb25311912 [0,1,0,0,0,0|2,0,1]=4 481 B14R1.156 N#CCOC(=O)NCc1ccccc1 Amb27876466 [0,1,0,0,0,0|1,0,2]=4 482 B14R1.156 NCCCC(=O)C#Cc1ccccc1 Amb27758109 [0,1,0,0,0,0|1,0,2]=4 483 B14R1.156 NCCCC(=O)NCc1ccccc1 Amb5785143 [0,1,0,0,0,0|2,0,1]=4 484 B14R1.156 NCCCC(=O)OCc1ccccc1 Amb33038335 [0,1,0,0,0,0|2,0,1]=4 485 B14R1.156 NCCCC(=O)OCc1ccccc1 Amb4247412 [0,1,0,0,0,0|2,0,1]=4 486 B14R1.156 NCCCC(=O)OCc1ccccc1 Amb594688 [0,1,0,0,0,0|2,0,1]=4 487 B14R1.156 NCCNC(=O)COc1ccccc1 Amb6247044 [0,1,0,0,0,0|2,0,1]=4 488 B14R1.156 NCCNC(=O)COc1ccccc1 Amb7969460 [0,1,0,0,0,0|2,0,1]=4 489 B14R1.156 NCCNC(=O)NCc1ccccc1 Amb17235652 [0,1,0,0,0,0|2,0,1]=4 490 B14R1.156 NCCNC(=O)OCc1ccccc1 Amb2720022 [0,1,0,0,0,0|2,0,1]=4 491 B14R1.156 NCCNC(=O)OCc1ccccc1 Amb3941558 [0,1,0,0,0,0|2,0,1]=4 492 B14R1.156 NCCOC(=O)NCc1ccccc1 Amb27870655 [0,1,0,0,0,0|1,0,1]=3 493 B14R1.156 O=C(CCCBr)OCc1ccccc1 Amb2413170 [0,1,0,0,0,0|2,0,1]=4 494 B14R1.156 O=C(CCCO)OCc1ccccc1 Amb27877363 [0,1,0,0,0,0|2,0,1]=4 495 B14R1.156 O=C(CCCS)OCc1ccccc1 Amb27171726 [0,1,0,0,0,0|2,0,1]=4 496 B14R1.156 O=C(COc1ccccc1)OCCBr Amb24065427 [0,1,0,0,0,0|1,0,1]=3 497 B14R1.156 O=C(NCCBr)OCc1ccccc1 Amb10608828 [0,1,0,0,0,0|2,0,1]=4 498 B14R1.156 O=C(NCCCl)NCc1ccccc1 Amb9678498 [0,1,0,0,0,0|2,0,1]=4 499 B14R1.156 O=C(NCCCl)OCc1ccccc1 Amb27387761 [0,1,0,0,0,0|2,0,1]=4 500 B14R1.156 O=C(NCCF)OCc1ccccc1 Amb27591394 [0,1,0,0,0,0|2,0,1]=4 501 B14R1.156 O=C(NCCI)OCc1ccccc1 Amb21962791 [0,1,0,0,0,0|2,0,1]=4 502 B14R1.156 O=C(NCCO)NCc1ccccc1 Amb27230491 [0,1,0,0,0,0|2,0,1]=4 503 B14R1.156 O=C(NCCO)OCc1ccccc1 Amb17719245 [0,1,0,0,0,0|2,0,1]=4 504 B14R1.156 O=C(NCCS)NCc1ccccc1 Amb27957788 [0,1,0,0,0,0|2,0,1]=4 505 B14R1.156 O=C(NCc1ccccc1)OCCO Amb24335977 [0,1,0,0,0,0|1,0,1]=3 506 B14R1.156 O=C(\C=C\c1ccccc1)NCCO Amb5799194 [0,1,0,0,0,0|1,0,0]=2 507 B14R1.156 O=CCOC(=O)NCc1ccccc1 Amb28251211 [0,1,0,0,0,0|1,0,2]=4 508 B14R1.156 O=CCOC(=O)OCc1ccccc1 Amb27481625 [0,1,0,0,0,0|1,0,2]=4 509 B14R1.502 C=C(\C=C\c1ccc(F)cc1)CCN Amb33201730 [0,1,0,0,0,0|3,0,0]=4 510 B14R1.502 CCCC(=O)CSc1ccc(Br)cc1 Amb32683090 [0,1,0,0,0,0|2,0,1]=4 511 B14R1.502 CCCC(=O)CSc1ccc(C)cc1 Amb32683100 [0,1,0,0,0,0|2,0,1]=4 512 B14R1.502 CCCC(=O)CSc1ccc(Cl)cc1 Amb32683095 [0,1,0,0,0,0|2,0,1]=4 513 B14R1.502 CCCC(=O)CSc1ccc(F)cc1 Amb32683097 [0,1,0,0,0,0|2,0,1]=4 514 B14R1.502 CCCC(=O)NCc1ccc(N)cc1 Amb17139364 [0,1,0,0,0,0|2,0,1]=4 515 B14R1.502 CCCC(=O)NNc1ccc(Cl)cc1 Amb4006248 [0,1,0,0,0,0|3,0,0]=4 516 B14R1.502 CCNC(=O)CCc1ccc(N)cc1 Amb8941585 [0,1,0,0,0,0|1,0,2]=4 517 B14R1.502 CCNC(=O)CCc1ccc(O)cc1 Amb32884634 [0,1,0,0,0,0|1,0,2]=4 518 B14R1.502 CCNC(=O)COc1ccc(Br)cc1 Amb4894325 [0,1,0,0,0,0|2,0,1]=4 519 B14R1.502 CCNC(=O)COc1ccc(N)cc1 Amb1111737 [0,1,0,0,0,0|2,0,1]=4 520 B14R1.502 CCNC(=O)NCc1ccc(Br)cc1 Amb27834013 [0,1,0,0,0,0|2,0,1]=4 521 B14R1.502 CCNC(=O)NCc1ccc(C)cc1 Amb1233670 [0,1,0,0,0,0|2,0,1]=4 522 B14R1.502 CCNC(=O)NCc1ccc(Cl)cc1 Amb162907 [0,1,0,0,0,0|2,0,1]=4 523 B14R1.502 CCNC(=O)NCc1ccc(N)cc1 Amb18969348 [0,1,0,0,0,0|2,0,1]=4 524 B14R1.502 CCNC(=O)NCc1ccc(O)cc1 Amb28070159 [0,1,0,0,0,0|2,0,1]=4 525 B14R1.502 CCNC(=O)NNc1ccc(C)cc1 Amb24336748 [0,1,0,0,0,0|3,0,0]=4 526 B14R1.502 CCNC(=O)\C=C\c1ccc(Br)cc1 Amb6881338 [0,1,0,0,0,0|1,0,0]=2 527 B14R1.502 CCNC(=O)\C=C\c1ccc(Cl)cc1 Amb17775297 [0,1,0,0,0,0|1,0,0]=2 528 B14R1.502 CCNC(=O)\C=C\c1ccc(F)cc1 Amb17859931 [0,1,0,0,0,0|1,0,0]=2 529 B14R1.502 CCNC(=O)\C=C\c1ccc(N)cc1 Amb27588212 [0,1,0,0,0,0|1,0,0]=2 530 B14R1.502 CCOC(=O)C#Cc1ccc(Br)cc1 Amb24643932 [0,1,0,0,0,0|0,0,2]=3 531 B14R1.502 CCOC(=O)C#Cc1ccc(Br)cn1 Amb35644577 [0,1,0,0,0,0|1,0,2]=4 532 B14R1.502 CCOC(=O)C#Cc1ccc(C)cc1 Amb25205982 [0,1,0,0,0,0|0,0,2]=3 533 B14R1.502 CCOC(=O)C#Cc1ccc(C)cn1 Amb33168765 [0,1,0,0,0,0|1,0,2]=4 534 B14R1.502 CCOC(=O)C#Cc1ccc(C)nc1 Amb25352325 [0,1,0,0,0,0|1,0,2]=4 535 B14R1.502 CCOC(=O)C#Cc1ccc(Cl)cc1 Amb19515859 [0,1,0,0,0,0|0,0,2]=3 536 B14R1.502 CCOC(=O)C#Cc1ccc(F)cc1 Amb25814599 [0,1,0,0,0,0|0,0,2]=3 537 B14R1.502 CCOC(=O)C#Cc1ccc(F)cn1 Amb25304036 [0,1,0,0,0,0|1,0,2]=4 538 B14R1.502 CCOC(=O)C#Cc1ccc(N)cc1 Amb27265922 [0,1,0,0,0,0|0,0,2]=3 539 B14R1.502 CCOC(=O)C#Cc1ccc(O)cc1 Amb25042066 [0,1,0,0,0,0|0,0,2]=3 540 B14R1.502 CCOC(=O)CCc1ccc(Br)cc1 Amb15692691 [0,1,0,0,0,0|0,0,2]=3 541 B14R1.502 CCOC(=O)CCc1ccc(Br)cn1 Amb32414280 [0,1,0,0,0,0|1,0,2]=4 542 B14R1.502 CCOC(=O)CCc1ccc(C)cc1 Amb19073887 [0,1,0,0,0,0|0,0,2]=3 543 B14R1.502 CCOC(=O)CCc1ccc(Cl)cc1 Amb21962138 [0,1,0,0,0,0|0,0,2]=3 544 B14R1.502 CCOC(=O)CCc1ccc(F)cc1 Amb21962143 [0,1,0,0,0,0|0,0,2]=3 545 B14R1.502 CCOC(=O)CCc1ccc(F)nc1 Amb28984234 [0,1,0,0,0,0|1,0,2]=4 546 B14R1.502 CCOC(=O)CCc1ccc(N)cc1 Amb19042046 [0,1,0,0,0,0|0,0,2]=3 547 B14R1.502 CCOC(=O)CCc1ccc(N)cc1 Amb33548435 [0,1,0,0,0,0|0,0,2]=3 548 B14R1.502 CCOC(=O)CCc1ccc(N)cn1 Amb33748687 [0,1,0,0,0,0|1,0,2]=4 549 B14R1.502 CCOC(=O)CCc1ccc(N)nc1 Amb30594124 [0,1,0,0,0,0|1,0,2]=4 550 B14R1.502 CCOC(=O)CCc1ccc(O)cc1 Amb2722568 [0,1,0,0,0,0|0,0,2]=3 551 B14R1.502 CCOC(=O)CNc1ccc(Br)cc1 Amb1798245 [0,1,0,0,0,0|1,0,1]=3 552 B14R1.502 CCOC(=O)CNc1ccc(Br)cn1 Amb33748454 [0,1,0,0,0,0|2,0,1]=4 553 B14R1.502 CCOC(=O)CNc1ccc(C)cc1 Amb33527069 [0,1,0,0,0,0|1,0,1]=3 554 B14R1.502 CCOC(=O)CNc1ccc(Cl)cc1 Amb6711991 [0,1,0,0,0,0|1,0,1]=3 555 B14R1.502 CCOC(=O)CNc1ccc(F)cc1 Amb1649074 [0,1,0,0,0,0|1,0,1]=3 556 B14R1.502 CCOC(=O)CNc1ccc(F)cn1 Amb19044823 [0,1,0,0,0,0|2,0,1]=4 557 B14R1.502 CCOC(=O)CNc1ccc(I)cc1 Amb1003062 [0,1,0,0,0,0|1,0,1]=3 558 B14R1.502 CCOC(=O)CNc1ccc(N)cc1 Amb19051516 [0,1,0,0,0,0|1,0,1]=3 559 B14R1.502 CCOC(=O)CNc1ccc(N)cn1 Amb19052220 [0,1,0,0,0,0|2,0,1]=4 560 B14R1.502 CCOC(=O)COc1ccc(Br)nc1 Amb32410845 [0,1,0,0,0,0|2,0,1]=4 561 B14R1.502 CCOC(=O)COc1ccc(C)cc1 Amb6555666 [0,1,0,0,0,0|1,0,1]=3 562 B14R1.502 CCOC(=O)COc1ccc(C)cn1 Amb24063764 [0,1,0,0,0,0|2,0,1]=4 563 B14R1.502 CCOC(=O)COc1ccc(Cl)cc1 Amb6367962 [0,1,0,0,0,0|1,0,1]=3 564 B14R1.502 CCOC(=O)COc1ccc(F)cc1 Amb6545563 [0,1,0,0,0,0|1,0,1]=3 565 B14R1.502 CCOC(=O)COc1ccc(I)cc1 Amb9203437 [0,1,0,0,0,0|1,0,1]=3 566 B14R1.502 CCOC(=O)COc1ccc(N)cc1 Amb1121477 [0,1,0,0,0,0|1,0,1]=3 567 B14R1.502 CCOC(=O)COc1ccc(N)cn1 Amb24103510 [0,1,0,0,0,0|2,0,1]=4 568 B14R1.502 CCOC(=O)COc1ccc(O)cc1 Amb18652309 [0,1,0,0,0,0|1,0,1]=3 569 B14R1.502 CCOC(=O)CSc1ccc(N)cc1 Amb8930381 [0,1,0,0,0,0|1,0,1]=3 570 B14R1.502 CCOC(=O)NNc1ccc(F)cc1 Amb26524896 [0,1,0,0,0,0|2,0,0]=3 571 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33716486 [0,1,0,0,0,0|0,0,0]=1 572 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cc1 Amb33870372 [0,1,0,0,0,0|0,0,0]=1 573 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)cn1 Amb28653453 [0,1,0,0,0,0|1,0,0]=2 574 B14R1.502 CCOC(=O)\C=C\c1ccc(Br)nc1 Amb28989668 [0,1,0,0,0,0|1,0,0]=2 575 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cc1 Amb30526854 [0,1,0,0,0,0|0,0,0]=1 576 B14R1.502 CCOC(=O)\C=C\c1ccc(C)cn1 Amb30594534 [0,1,0,0,0,0|1,0,0]=2 577 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb24078556 [0,1,0,0,0,0|0,0,0]=1 578 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cc1 Amb33715893 [0,1,0,0,0,0|0,0,0]=1 579 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)cn1 Amb33469201 [0,1,0,0,0,0|1,0,0]=2 580 B14R1.502 CCOC(=O)\C=C\c1ccc(Cl)nc1 Amb24097721 [0,1,0,0,0,0|1,0,0]=2 581 B14R1.502 CCOC(=O)\C=C\c1ccc(F)cc1 Amb24089413 [0,1,0,0,0,0|0,0,0]=1 582 B14R1.502 CCOC(=O)\C=C\c1ccc(F)nc1 Amb33469198 [0,1,0,0,0,0|1,0,0]=2 583 B14R1.502 CCOC(=O)\C=C\c1ccc(N)cc1 Amb1197562 [0,1,0,0,0,0|0,0,0]=1 584 B14R1.502 CCOC(=O)\C=C\c1ccc(N)nc1 Amb2697295 [0,1,0,0,0,0|1,0,0]=2 585 B14R1.502 CCOC(=O)\C=C\c1ccc(O)cc1 Amb2445150 [0,1,0,0,0,0|0,0,0]=1 586 B14R1.502 CCOC(=O)\C=N\c1ccc(Br)cc1 Amb20241622 [0,1,0,0,0,0|1,0,0]=2 587 B14R1.502 CCOC(=O)\N=C\c1ccc(Cl)cc1 Amb29599218 [0,1,0,0,0,0|1,0,0]=2 588 B14R1.502 CCOC(=O)\N=C\c1ccc(F)cc1 Amb33513280 [0,1,0,0,0,0|1,0,0]=2 589 B14R1.502 CNCC(=O)\C=C\c1ccc(F)cc1 Amb33326727 [0,1,0,0,0,0|2,0,0]=3 590 B14R1.502 Cc1ccc(\C=C\C(=O)N=[N+]=[N-])cc1 Amb22055753 [0,1,0,0,0,0|3,0,0]=4 591 B14R1.502 Cc1ccc(\C=C\C(=O)NC#N)cc1 Amb27794069 [0,1,0,0,0,0|2,0,1]=4 592 B14R1.502 N#CNC(=O)\C=C\c1ccc(Br)cc1 Amb27478207 [0,1,0,0,0,0|2,0,1]=4 593 B14R1.502 NCCC(=O)\C=C\c1ccc(F)cc1 Amb33326731 [0,1,0,0,0,0|2,0,0]=3 594 B14R1.502 [N-]=[N+]=NC(=O)\C=C\c1ccc(F)cc1 Amb27607758 [0,1,0,0,0,0|3,0,0]=4 595 B14R1.598 CCCC(=O)CSc1ccccc1Br Amb32683092 [0,1,0,0,0,0|2,0,1]=4 596 B14R1.598 CCCC(=O)CSc1ccccc1C Amb32683099 [0,1,0,0,0,0|2,0,1]=4 597 B14R1.598 CCCC(=O)CSc1ccccc1Cl Amb32683093 [0,1,0,0,0,0|2,0,1]=4 598 B14R1.598 CCCC(=O)CSc1ccccc1F Amb32683096 [0,1,0,0,0,0|2,0,1]=4 599 B14R1.598 CCNC(=O)CCc1ccccc1N Amb8941583 [0,1,0,0,0,0|1,0,2]=4 600 B14R1.598 CCNC(=O)COc1ccccc1Br Amb6260643 [0,1,0,0,0,0|2,0,1]=4 601 B14R1.598 CCNC(=O)COc1ccccc1N Amb1119533 [0,1,0,0,0,0|2,0,1]=4 602 B14R1.598 CCNC(=O)NCc1ccccc1C Amb497429 [0,1,0,0,0,0|2,0,1]=4 603 B14R1.598 CCNC(=O)NCc1ccccc1O Amb27182984 [0,1,0,0,0,0|2,0,1]=4 604 B14R1.598 CCNC(=O)NNc1ccccc1C Amb26568476 [0,1,0,0,0,0|3,0,0]=4 605 B14R1.598 CCOC(=O)C#Cc1ccccc1C Amb24369087 [0,1,0,0,0,0|0,0,2]=3 606 B14R1.598 CCOC(=O)C#Cc1ccccc1Cl Amb24079963 [0,1,0,0,0,0|0,0,2]=3 607 B14R1.598 CCOC(=O)C#Cc1ccccc1F Amb24079971 [0,1,0,0,0,0|0,0,2]=3 608 B14R1.598 CCOC(=O)C#Cc1ccccc1N Amb26490907 [0,1,0,0,0,0|0,0,2]=3 609 B14R1.598 CCOC(=O)C#Cc1ccccc1O Amb24613197 [0,1,0,0,0,0|0,0,2]=3 610 B14R1.598 CCOC(=O)C#Cc1ccncc1F Amb27404421 [0,1,0,0,0,0|1,0,2]=4 611 B14R1.598 CCOC(=O)CCN1C=CC=CC1=S Amb19804602 [0,1,0,0,0,0|1,0,2]=4 612 B14R1.598 CCOC(=O)CCc1ccccc1Br Amb15692688 [0,1,0,0,0,0|0,0,2]=3 613 B14R1.598 CCOC(=O)CCc1ccccc1C Amb19073901 [0,1,0,0,0,0|0,0,2]=3 614 B14R1.598 CCOC(=O)CCc1ccccc1Cl Amb21962867 [0,1,0,0,0,0|0,0,2]=3 615 B14R1.598 CCOC(=O)CCc1ccccc1F Amb21962868 [0,1,0,0,0,0|0,0,2]=3 616 B14R1.598 CCOC(=O)CCc1ccccc1N Amb33803544 [0,1,0,0,0,0|0,0,2]=3 617 B14R1.598 CCOC(=O)CCc1ccccc1O Amb18651832 [0,1,0,0,0,0|0,0,2]=3 618 B14R1.598 CCOC(=O)CCc1cccnc1Cl Amb32666979 [0,1,0,0,0,0|1,0,2]=4 619 B14R1.598 CCOC(=O)CCc1cccnc1F Amb33995097 [0,1,0,0,0,0|1,0,2]=4 620 B14R1.598 CCOC(=O)CCc1ccncc1Br Amb21964460 [0,1,0,0,0,0|1,0,2]=4 621 B14R1.598 CCOC(=O)CCc1ncccc1F Amb28984205 [0,1,0,0,0,0|1,0,2]=4 622 B14R1.598 CCOC(=O)CNc1ccccc1C Amb6714296 [0,1,0,0,0,0|1,0,1]=3 623 B14R1.598 CCOC(=O)CNc1ccccc1Cl Amb6712399 [0,1,0,0,0,0|1,0,1]=3 624 B14R1.598 CCOC(=O)CNc1ccccc1F Amb6712589 [0,1,0,0,0,0|1,0,1]=3 625 B14R1.598 CCOC(=O)CNc1ccccc1N Amb19051515 [0,1,0,0,0,0|1,0,1]=3 626 B14R1.598 CCOC(=O)CNc1ncccc1Br Amb33744151 [0,1,0,0,0,0|2,0,1]=4 627 B14R1.598 CCOC(=O)CNc1ncccc1N Amb19052224 [0,1,0,0,0,0|2,0,1]=4 628 B14R1.598 CCOC(=O)COc1ccccc1Br Amb6550418 [0,1,0,0,0,0|1,0,1]=3 629 B14R1.598 CCOC(=O)COc1ccccc1C Amb6357570 [0,1,0,0,0,0|1,0,1]=3 630 B14R1.598 CCOC(=O)COc1ccccc1Cl Amb6856205 [0,1,0,0,0,0|1,0,1]=3 631 B14R1.598 CCOC(=O)COc1ccccc1F Amb7755238 [0,1,0,0,0,0|1,0,1]=3 632 B14R1.598 CCOC(=O)COc1ccccc1I Amb9285952 [0,1,0,0,0,0|1,0,1]=3 633 B14R1.598 CCOC(=O)COc1ccccc1O Amb1199351 [0,1,0,0,0,0|1,0,1]=3 634 B14R1.598 CCOC(=O)COc1cccnc1Br Amb9901770 [0,1,0,0,0,0|2,0,1]=4 635 B14R1.598 CCOC(=O)COc1cccnc1N Amb9208374 [0,1,0,0,0,0|2,0,1]=4 636 B14R1.598 CCOC(=O)COc1ncccc1C Amb23590350 [0,1,0,0,0,0|2,0,1]=4 637 B14R1.598 CCOC(=O)COc1ncccc1N Amb24103508 [0,1,0,0,0,0|2,0,1]=4 638 B14R1.598 CCOC(=O)COc1ncccc1O Amb24103509 [0,1,0,0,0,0|2,0,1]=4 639 B14R1.598 CCOC(=O)NNc1ccncc1N Amb27386818 [0,1,0,0,0,0|3,0,0]=4 640 B14R1.598 CCOC(=O)\C=C\c1ccccc1Br Amb33997762 [0,1,0,0,0,0|0,0,0]=1 641 B14R1.598 CCOC(=O)\C=C\c1ccccc1C Amb33358074 [0,1,0,0,0,0|0,0,0]=1 642 B14R1.598 CCOC(=O)\C=C\c1ccccc1Cl Amb34103701 [0,1,0,0,0,0|0,0,0]=1 643 B14R1.598 CCOC(=O)\C=C\c1ccccc1F Amb2699675 [0,1,0,0,0,0|0,0,0]=1 644 B14R1.598 CCOC(=O)\C=C\c1ccccc1N Amb17777074 [0,1,0,0,0,0|0,0,0]=1 645 B14R1.598 CCOC(=O)\C=C\c1ccccc1O Amb18651061 [0,1,0,0,0,0|0,0,0]=1 646 B14R1.598 CCOC(=O)\C=C\c1cccnc1Br Amb33972638 [0,1,0,0,0,0|1,0,0]=2 647 B14R1.598 CCOC(=O)\C=C\c1cccnc1Cl Amb24090584 [0,1,0,0,0,0|1,0,0]=2 648 B14R1.598 CCOC(=O)\C=C\c1cccnc1F Amb33972618 [0,1,0,0,0,0|1,0,0]=2 649 B14R1.598 CCOC(=O)\C=C\c1ccncc1F Amb33469196 [0,1,0,0,0,0|1,0,0]=2 650 B14R1.598 CCOC(=O)\C=C\c1cnccc1C Amb32423788 [0,1,0,0,0,0|1,0,0]=2 651 B14R1.598 CCOC(=O)\C=C\c1cnccc1N Amb10844701 [0,1,0,0,0,0|1,0,0]=2 652 B14R1.598 CCOC(=O)\C=C\c1ncccc1F Amb33972617 [0,1,0,0,0,0|1,0,0]=2 653 B14R1.598 CC\C=C(C)\C=N\c1ccccc1O Amb28409160 [0,1,0,0,0,0|3,0,0]=4 654 B14R1.598 CONC(=O)\C=C\c1ccccc1Br Amb27857184 [0,1,0,0,0,0|2,0,0]=3 655 B14R1.598 CONC(=O)\C=C\c1ccccc1F Amb28201232 [0,1,0,0,0,0|2,0,0]=3 656 B14R1.598 [N-]=[N+]=NC(=O)\C=C\c1ccccc1Br Amb28280191 [0,1,0,0,0,0|3,0,0]=4 657 B14R1.756 C=C(CC)C(=O)OCc1ccccc1 Amb22347956 [0,1,0,0,0,0|2,0,1]=4 658 B14R1.756 CCC(Br)C(=O)NCc1ccccc1 Amb9174124 [0,1,0,0,0,0|2,0,1]=4 659 B14R1.756 CCC(C)C(=O)C#Cc1ccccc1 Amb27662388 [0,1,0,0,0,0|1,0,2]=4 660 B14R1.756 CCC(C)C(=O)CSc1ccccc1 Amb32682589 [0,1,0,0,0,0|2,0,1]=4 661 B14R1.756 CCC(C)C(=O)NCc1ccccc1 Amb3886895 [0,1,0,0,0,0|2,0,1]=4 662 B14R1.756 CCC(Cl)C(=O)NCc1ccccc1 Amb1229165 [0,1,0,0,0,0|2,0,1]=4 663 B14R1.756 CCC(N)C(=O)NCc1ccccc1 Amb9267786 [0,1,0,0,0,0|2,0,1]=4 664 B14R1.756 CCC(N)C(=O)NNc1ccccc1 Amb28454815 [0,1,0,0,0,0|3,0,0]=4 665 B14R1.756 CCC(N)C(=O)OCc1ccccc1 Amb19042038 [0,1,0,0,0,0|2,0,1]=4 666 B14R1.756 CCC(O)C(=O)NCc1ccccc1 Amb27793402 [0,1,0,0,0,0|2,0,1]=4 667 B14R1.756 CCC(O)C(=O)OCc1ccccc1 Amb27627281 [0,1,0,0,0,0|2,0,1]=4 668 B14R1.756 CCC(S)C(=O)NCc1ccccc1 Amb28128230 [0,1,0,0,0,0|2,0,1]=4 669 B14R1.756 CCC(S)C(=O)OCc1ccccc1 Amb28349891 [0,1,0,0,0,0|2,0,1]=4 670 B14R1.756 CC[C@@H](N)C(=O)C#Cc1ccccc1 Amb35596818 [0,1,0,0,0,0|1,0,2]=4 671 B14R1.756 CC[C@@H](O)C(=O)NCc1ccccc1 Amb28343252 [0,1,0,0,0,0|2,0,1]=4 672 B14R1.756 CC[C@H](C)C(=O)NCc1ccccc1 Amb27643489 [0,1,0,0,0,0|2,0,1]=4 673 B14R1.756 CC[C@H](N)C(=O)C#Cc1ccccc1 Amb35601316 [0,1,0,0,0,0|1,0,2]=4 674 B14R1.756 CC[C@H](N)C(=O)NCc1ccccc1 Amb27256982 [0,1,0,0,0,0|2,0,1]=4 675 B14R1.756 CC[C@H](O)C(=O)NCc1ccccc1 Amb28053819 [0,1,0,0,0,0|2,0,1]=4 676 B14R1.756 COC(=O)C(=O)\C=C\c1ccccc1 Amb31029020 [0,1,0,0,0,0|2,0,0]=3 677 B14R1.756 CON(C)C(=O)\C=C\c1ccccc1 Amb10569707 [0,1,0,0,0,0|2,0,0]=3 678 B14R1.818 C=C(\C=C\c1ccccc1)NC(C)=O Amb27210869 [0,1,0,0,0,0|2,0,1]=4 679 B14R1.818 CC(=C\C(C)O)\C=C\c1ccccc1 Amb27472779 [0,1,0,0,0,0|2,0,0]=3 680 B14R1.818 CC(=O)CC(=O)\C=C\c1ccccc1 Amb17594879 [0,1,0,0,0,0|1,0,1]=3 681 B14R1.818 CC(=O)NC(=O)\C=C/c1ccccn1 Amb27464445 [0,1,0,0,0,0|2,0,1]=4 682 B14R1.818 CC(=O)NC(=O)\C=C\c1ccccn1 Amb27879510 [0,1,0,0,0,0|2,0,1]=4 683 B14R1.818 CC(C)CC(=O)CCc1ccccc1 Amb3940664 [0,1,0,0,0,0|1,0,2]=4 684 B14R1.818 CC(C)CC(=O)NCc1ccccc1 Amb3109685 [0,1,0,0,0,0|2,0,1]=4 685 B14R1.818 CC(C)NC(=O)CCc1ccccc1 Amb1835404 [0,1,0,0,0,0|1,0,2]=4 686 B14R1.818 CC(C)NC(=O)CNc1ccccc1 Amb6707001 [0,1,0,0,0,0|2,0,1]=4 687 B14R1.818 CC(C)NC(=O)NCc1ccccc1 Amb3994179 [0,1,0,0,0,0|2,0,1]=4 688 B14R1.818 CC(C)NC(=O)NNc1ccccc1 Amb24531944 [0,1,0,0,0,0|3,0,0]=4 689 B14R1.818 CC(C)NC(=O)NSc1ccccc1 Amb28408901 [0,1,0,0,0,0|3,0,0]=4 690 B14R1.818 CC(C)NC(=O)OCc1ccccc1 Amb22460564 [0,1,0,0,0,0|2,0,1]=4 691 B14R1.818 CC(C)NC(=O)\C=C\c1ccccc1 Amb3096736 [0,1,0,0,0,0|1,0,0]=2 692 B14R1.818 CC(C)OC(=O)C#Cc1ccccc1 Amb27662961 [0,1,0,0,0,0|0,0,2]=3 693 B14R1.818 CC(C)OC(=S)NCc1ccccc1 Amb27794893 [0,1,0,0,0,0|1,1,1]=4 694 B14R1.818 CC(Cl)OC(=O)OCc1ccccc1 Amb25202460 [0,1,0,0,0,0|1,0,1]=3 695 B14R1.818 CC(N)CC(=O)NNc1ccccc1 Amb27810166 [0,1,0,0,0,0|3,0,0]=4 696 B14R1.818 CC(N)CC(=O)OCc1ccccc1 Amb19042037 [0,1,0,0,0,0|2,0,1]=4 697 B14R1.818 CC(N)CC(=O)OCc1ccccc1 Amb32681166 [0,1,0,0,0,0|2,0,1]=4 698 B14R1.818 CC(N)NC(=O)OCc1ccccc1 Amb27387880 [0,1,0,0,0,0|2,0,1]=4 699 B14R1.818 CC(O)CC(=O)NCc1ccccc1 Amb28287743 [0,1,0,0,0,0|2,0,1]=4 700 B14R1.818 CN(C)NC(=O)\C=C\c1ccccc1 Amb2620529 [0,1,0,0,0,0|2,0,0]=3 701 B14R1.818 CN(C)\N=C(N)/C=C/c1ccccc1 Amb27626897 [0,1,0,0,0,0|3,0,0]=4 702 B14R1.818 C[C@H](N)CC(=O)OCc1ccccc1 Amb27249734 [0,1,0,0,0,0|2,0,1]=4 703 B14R1.818 N=C(N)NC(=O)\C=C\c1ccccc1 Amb28291434 [0,1,0,0,0,0|2,0,1]=4 704 B14R1.818 NC(=O)NC(=O)\C=C\c1ccccc1 Amb25291849 [0,1,0,0,0,0|2,0,1]=4 705 B14R1.818 NC(=S)NC(=O)\C=C\c1ccccc1 Amb4148846 [0,1,0,0,0,0|2,0,1]=4 706 B14R2.15 CCC1C(=O)CC1c2ccccc2 Amb27608698 [0,0,0,1,0,0|1,0,2]=4 707 B14R2.15 CCC1C(=O)NC1c2ccccc2 Amb2388317 [0,0,0,1,0,0|2,0,1]=4 708 B14R2.15 CC[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb27640614 [0,0,0,1,0,0|2,0,1]=4 709 B14R2.15 O=C1C=C(c2ccccc2)\C1=N/O Amb27211894 [0,0,0,1,0,0|3,0,0]=4 710 B14R2.21 C=C1OCCC(c2ccccc2)O1 Amb25897352 [0,0,0,1,0,0|2,0,1]=4 711 B14R2.21 NC1=CC(c2ccccc2)=CCN1 Amb28118874 [0,0,0,1,0,0|2,0,1]=4 712 B14R2.21 N[C@@H]1C=C(c2ccccc2)CCC1 Amb27832427 [0,0,0,1,0,0|2,0,1]=4 713 B14R2.21 O=C1C=C(c2ccccc2)C=CO1 Amb27480961 [0,0,0,1,0,0|0,0,2]=3 714 B14R2.21 O=C1C=C(c2ccccc2)C=NN1 Amb25859226 [0,0,0,1,0,0|2,0,1]=4 715 B14R2.21 O=C1C=C(c2ccccc2)CCC1 Amb2613651 [0,0,0,1,0,0|1,0,0]=2 716 B14R2.21 O=C1C=C(c2ccccc2)N=CN1 Amb18001789 [0,0,0,1,0,0|2,0,1]=4 717 B14R2.21 O=C1C=C(c2ccccc2)OCC1 Amb22750040 [0,0,0,1,0,0|2,0,0]=3 718 B14R2.21 O=C1C=C(c2cccnc2)CCC1 Amb27837073 [0,0,0,1,0,0|2,0,0]=3 719 B14R2.21 O=C1C=C(c2cncnc2)CCC1 Amb27170240 [0,0,0,1,0,0|3,0,0]=4 720 B14R2.21 O=C1C=COC(c2ccccc2)=C1 Amb22750060 [0,0,0,1,0,0|2,0,1]=4 721 B14R2.21 O=C1CC(c2ccccc2)CCN1 Amb20171612 [0,0,0,1,0,0|1,0,2]=4 722 B14R2.21 O=C1CC(c2ccccc2)CCO1 Amb22499444 [0,0,0,1,0,0|0,0,2]=3 723 B14R2.21 O=C1CCCC(c2ccccc2)C1 Amb18065540 [0,0,0,1,0,0|1,0,2]=4 724 B14R2.21 O=C1CCCC(c2ccccc2)N1 Amb2615419 [0,0,0,1,0,0|2,0,1]=4 725 B14R2.21 O=C1CCCN(c2ccccc2)N1 Amb4004671 [0,0,0,1,0,0|3,0,0]=4 726 B14R2.21 O=C1CCC[C@H](c2ccccc2)C1 Amb26881373 [0,0,0,1,0,0|1,0,2]=4 727 B14R2.21 O=C1C[C@@H](c2ccccc2)CCO1 Amb27187321 [0,0,0,1,0,0|0,0,2]=3 728 B14R2.21 O=C1NC(c2ccccc2)CCO1 Amb27481645 [0,0,0,1,0,0|1,0,1]=3 729 B14R2.21 O=C1NC(c2ccccn2)CCO1 Amb27396944 [0,0,0,1,0,0|2,0,1]=4 730 B14R2.21 O=C1NCCC(c2ccccc2)N1 Amb25733512 [0,0,0,1,0,0|2,0,1]=4 731 B14R2.21 O=C1NN(c2ccccc2)CCO1 Amb27826339 [0,0,0,1,0,0|2,0,0]=3 732 B14R2.21 O=C1N[C@H](c2ccccn2)CCO1 Amb27172183 [0,0,0,1,0,0|2,0,1]=4 733 B14R2.21 O=C1N[C@H](c2ccncc2)CCO1 Amb27951607 [0,0,0,1,0,0|2,0,1]=4 734 B14R2.21 OC1C=C(c2ccccc2)CCC1 Amb6360004 [0,0,0,1,0,0|1,0,2]=4 735 B14R2.30 C=C1COC\C1=C\c2ccccc2 Amb27640106 [0,0,0,1,0,0|3,0,0]=4 736 B14R2.30 CC1NCC\C1=C/c2ccccc2 Amb18127119 [0,0,0,1,0,0|2,0,1]=4 737 B14R2.30 O=C1C=CC\C1=C/c2ccccc2 Amb27762533 [0,0,0,1,0,0|1,0,1]=3 738 B14R2.30 O=C1CCC=C1Oc2ccccc2 Amb28053964 [0,0,0,1,0,0|2,0,1]=4 739 B14R2.30 O=C1CCCC1Cc2ccccc2 Amb3994669 [0,0,0,1,0,0|1,0,2]=4 740 B14R2.30 O=C1CCCC1Sc2ccccc2 Amb9269994 [0,0,0,1,0,0|2,0,1]=4 741 B14R2.30 O=C1CCCN1Cc2ccccc2 Amb6357366 [0,0,0,1,0,0|2,0,1]=4 742 B14R2.30 O=C1CCC\C1=C/c2ccccc2 Amb1198712 [0,0,0,1,0,0|1,0,0]=2 743 B14R2.30 O=C1CCC\C1=C/c2cccnc2 Amb27857716 [0,0,0,1,0,0|2,0,0]=3 744 B14R2.30 O=C1CCC\C1=C/c2ccncc2 Amb1486635 [0,0,0,1,0,0|2,0,0]=3 745 B14R2.30 O=C1NC=N\C1=C/c2ccccc2 Amb25837555 [0,0,0,1,0,0|2,0,1]=4 746 B14R2.30 O=C1NCCC1Cc2ccccc2 Amb33547402 [0,0,0,1,0,0|1,0,2]=4 747 B14R2.30 O=C1NCCC1Nc2ccccc2 Amb27487099 [0,0,0,1,0,0|2,0,1]=4 748 B14R2.30 O=C1NCCN1Cc2ccccc2 Amb15701493 [0,0,0,1,0,0|2,0,1]=4 749 B14R2.30 O=C1NCC\C1=C/c2ccccc2 Amb22643155 [0,0,0,1,0,0|1,0,0]=2 750 B14R2.30 O=C1OCC=C1Sc2ccccc2 Amb21928057 [0,0,0,1,0,0|1,0,1]=3 751 B14R2.30 O=C1OCCC1Cc2ccccc2 Amb28363627 [0,0,0,1,0,0|0,0,2]=3 752 B14R2.30 O=C1OCCC1Nc2ccccc2 Amb25743171 [0,0,0,1,0,0|1,0,1]=3 753 B14R2.30 O=C1OCCC1Oc2ccccc2 Amb28140570 [0,0,0,1,0,0|1,0,1]=3 754 B14R2.30 O=C1OCCC1Oc2ccccn2 Amb27771678 [0,0,0,1,0,0|2,0,1]=4 755 B14R2.30 O=C1OCCC1Sc2ccccc2 Amb3836146 [0,0,0,1,0,0|1,0,1]=3 756 B14R2.30 O=C1OCCC1Sc2ccncc2 Amb28189960 [0,0,0,1,0,0|2,0,1]=4 757 B14R2.30 O=C1OCC\C1=C/c2ccccc2 Amb593520 [0,0,0,1,0,0|0,0,0]=1 758 B14R2.30 O[C@H]1CCC\C1=C/c2ccccc2 Amb28065329 [0,0,0,1,0,0|1,0,2]=4 759 B14R2.30 S=C1NCC\C1=C/c2ccccc2 Amb26445085 [0,0,0,1,0,0|1,1,0]=3 760 B14R2.52 CC1NC(=O)CCc2ccccc21 Amb27166512 [0,0,0,1,0,0|1,0,2]=4 761 B14R2.52 CC1NC(=O)COc2ccccc21 Amb4023388 [0,0,0,1,0,0|2,0,1]=4 762 B14R2.101 C(/Nc1ccccc1)=C2\CCCO2 Amb27453572 [0,0,0,1,0,0|2,0,0]=3 763 B14R2.101 C(/Sc1ccccc1)=C2/CCCN2 Amb27618452 [0,0,0,1,0,0|3,0,0]=4 764 B14R2.101 C(=C\C1CCCN1)/c2ccccc2 Amb23536589 [0,0,0,1,0,0|2,0,1]=4 765 B14R2.101 C(=C\C1CCCO1)/c2ccccc2 Amb4103388 [0,0,0,1,0,0|1,0,1]=3 766 B14R2.101 C(=C\C1OCCO1)/c2ccccc2 Amb26483959 [0,0,0,1,0,0|0,0,2]=3 767 B14R2.101 C(=C\C1OCCO1)/c2cccnc2 Amb27492900 [0,0,0,1,0,0|1,0,2]=4 768 B14R2.101 C(=C\c1ccccc1)/C2=NCCN2 Amb27474827 [0,0,0,1,0,0|2,0,0]=3 769 B14R2.101 C(=C\c1ccccc1)/C2=NCCS2 Amb28139613 [0,0,0,1,0,0|1,1,0]=3 770 B14R2.101 C(=C\c1cccnc1)/C2=NCCN2 Amb27866352 [0,0,0,1,0,0|3,0,0]=4 771 B14R2.101 C(=C\c1ccco1)/c2ccccc2 Amb26498528 [0,0,0,1,0,0|1,0,2]=4 772 B14R2.101 C(=N\C1CCCO1)/c2ccccc2 Amb26008253 [0,0,0,1,0,0|2,0,1]=4 773 B14R2.101 C1=C(CNc2ccccc2)OCC1 Amb27873530 [0,0,0,1,0,0|2,0,1]=4 774 B14R2.112 BrCCc1ccc2ccccc2c1 Amb8439759 [0,0,0,1,0,0|3,0,0]=4 775 B14R2.112 BrCCc1ccc2ccccc2n1 Amb25113626 [0,0,0,1,0,0|3,0,0]=4 776 B14R2.112 CC#Cc1ccc2ccccc2n1 Amb27208301 [0,0,0,1,0,0|2,0,1]=4 777 B14R2.112 CCC[n+]1ccc2ccccc2c1 Amb9825983 [0,0,0,1,0,0|3,0,0]=4 778 B14R2.112 CCCc1cc2ccccc2cn1 Amb27462348 [0,0,0,1,0,0|3,0,0]=4 779 B14R2.112 CCCc1ccc2ccccc2n1 Amb27265534 [0,0,0,1,0,0|2,0,0]=3 780 B14R2.112 CCCc1ccc2cccnc2n1 Amb27438611 [0,0,0,1,0,0|3,0,0]=4 781 B14R2.112 CCCc1ccc2ncccc2c1 Amb28067645 [0,0,0,1,0,0|3,0,0]=4 782 B14R2.112 CCNc1ccc2ccccc2c1 Amb7759811 [0,0,0,1,0,0|2,0,0]=3 783 B14R2.112 CCNc1cnc2ccccc2n1 Amb18285469 [0,0,0,1,0,0|3,0,0]=4 784 B14R2.112 CCOc1cc2ccccc2cn1 Amb2610107 [0,0,0,1,0,0|2,0,0]=3 785 B14R2.112 CCOc1ccc2ccccc2c1 Amb4017891 [0,0,0,1,0,0|1,0,0]=2 786 B14R2.112 CCOc1ccc2cccnc2c1 Amb27772101 [0,0,0,1,0,0|2,0,0]=3 787 B14R2.112 CCOc1ccc2cncnc2c1 Amb28291951 [0,0,0,1,0,0|3,0,0]=4 788 B14R2.112 CCOc1ccc2cnncc2c1 Amb27186341 [0,0,0,1,0,0|3,0,0]=4 789 B14R2.112 CCOc1ccc2ncccc2c1 Amb19106597 [0,0,0,1,0,0|2,0,0]=3 790 B14R2.112 CCOc1ccc2ncccc2n1 Amb25900314 [0,0,0,1,0,0|2,0,0]=3 791 B14R2.112 CCOc1ccc2ncncc2c1 Amb24476307 [0,0,0,1,0,0|3,0,0]=4 792 B14R2.112 CCOc1cnc2cccnc2n1 Amb27392564 [0,0,0,1,0,0|3,0,0]=4 793 B14R2.112 CCOc1cnc2ncccc2n1 Amb27392565 [0,0,0,1,0,0|3,0,0]=4 794 B14R2.112 CCSc1ccc2ccccc2c1 Amb24359866 [0,0,0,1,0,0|1,1,0]=3 795 B14R2.112 CCSc1ccc2ccccc2n1 Amb27972844 [0,0,0,1,0,0|1,1,0]=3 796 B14R2.112 CCSc1cnc2ccccc2n1 Amb27594469 [0,0,0,1,0,0|2,1,0]=4 797 B14R2.112 CNCc1ccc2ccccc2c1 Amb1106022 [0,0,0,1,0,0|3,0,0]=4 798 B14R2.112 CNCc1ccc2ccccc2n1 Amb6742539 [0,0,0,1,0,0|3,0,0]=4 799 B14R2.112 CSCc1ccc2ccccc2c1 Amb4006802 [0,0,0,1,0,0|3,0,0]=4 800 B14R2.112 CSCc1ccc2ccccc2n1 Amb27836677 [0,0,0,1,0,0|3,0,0]=4 801 B14R2.112 C\N=C\c1ccc2ccccc2n1 Amb27642803 [0,0,0,1,0,0|3,0,0]=4 802 B14R2.112 ClCOc1cnc2ccccc2c1 Amb28195835 [0,0,0,1,0,0|3,0,0]=4 803 B14R2.112 N#COc1ccc2ccccc2c1 Amb27445591 [0,0,0,1,0,0|2,0,1]=4 804 B14R2.112 NCCc1ccc2ccccc2c1 Amb6245305 [0,0,0,1,0,0|3,0,0]=4 805 B14R2.112 NCCc1ccc2ccccc2c1 Amb7969583 [0,0,0,1,0,0|3,0,0]=4 806 B14R2.112 NCCc1ccc2ccccc2n1 Amb6742401 [0,0,0,1,0,0|3,0,0]=4 807 B14R2.112 NCCc1ccc2ccccc2n1 Amb9182400 [0,0,0,1,0,0|3,0,0]=4 808 B14R2.112 OCCc1ccc2ccccc2c1 Amb3939094 [0,0,0,1,0,0|3,0,0]=4 809 B14R2.112 OCCc1ccc2ccccc2n1 Amb4093502 [0,0,0,1,0,0|3,0,0]=4 810 B14R2.112 SCCc1ccc2ccccc2c1 Amb28346891 [0,0,0,1,0,0|3,0,0]=4 811 B14R2.112 SCCc1ccc2ccccc2n1 Amb26552663 [0,0,0,1,0,0|3,0,0]=4 812 B14R2.203 BrCc1c(Br)ccc2ccccc12 Amb22040437 [0,0,0,1,0,0|3,0,0]=4 813 B14R2.203 BrCc1c(I)ccc2ccccc12 Amb25351584 [0,0,0,1,0,0|3,0,0]=4 814 B14R2.203 CCN1C(=O)C=Cc2ccccc21 Amb22360524 [0,0,0,1,0,0|1,0,0]=2 815 B14R2.203 CCN1C(=O)C=Cc2cccnc21 Amb26376360 [0,0,0,1,0,0|2,0,0]=3 816 B14R2.203 CCN1C(=O)C=Nc2ccccc21 Amb26053521 [0,0,0,1,0,0|2,0,0]=3 817 B14R2.203 CCN1C(=O)CCc2ccccc21 Amb28243212 [0,0,0,1,0,0|1,0,2]=4 818 B14R2.203 CCN1C(=O)CNc2ccccc21 Amb8471883 [0,0,0,1,0,0|2,0,1]=4 819 B14R2.203 CCN1C(=O)COc2ccccc21 Amb17096162 [0,0,0,1,0,0|2,0,1]=4 820 B14R2.203 CCN1C(=S)C=Cc2ccccc21 Amb20247294 [0,0,0,1,0,0|1,1,0]=3 821 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb1144527 [0,0,0,1,0,0|2,0,0]=3 822 B14R2.203 CC[n+]1c(C)ccc2ccccc21 Amb2609772 [0,0,0,1,0,0|2,0,0]=3 823 B14R2.203 CCc1c(C)cnc2ccccc12 Amb27596030 [0,0,0,1,0,0|3,0,0]=4 824 B14R2.203 CCc1c(N)ccc2ccccc12 Amb28322316 [0,0,0,1,0,0|2,0,0]=3 825 B14R2.203 CCc1c(N)cnc2ccccc12 Amb27179548 [0,0,0,1,0,0|3,0,0]=4 826 B14R2.203 CNc1c(C)ccc2ccccc12 Amb18553377 [0,0,0,1,0,0|3,0,0]=4 827 B14R2.203 COc1c(Br)ccc2ccccc12 Amb18559387 [0,0,0,1,0,0|3,0,0]=4 828 B14R2.203 COc1c(C)ccc2ccccc12 Amb25829445 [0,0,0,1,0,0|3,0,0]=4 829 B14R2.203 COc1c(Cl)ccc2ccccc12 Amb26846125 [0,0,0,1,0,0|3,0,0]=4 830 B14R2.203 COc1c(F)ccc2ccccc12 Amb26556586 [0,0,0,1,0,0|3,0,0]=4 831 B14R2.203 COc1c(I)ccc2ccccc12 Amb25237394 [0,0,0,1,0,0|3,0,0]=4 832 B14R2.203 COc1c(N)ccc2ccccc12 Amb18127046 [0,0,0,1,0,0|3,0,0]=4 833 B14R2.203 COc1c(O)ccc2ccccc12 Amb18127193 [0,0,0,1,0,0|2,0,1]=4 834 B14R2.203 CSc1c(N)ccc2ccccc12 Amb27860266 [0,0,0,1,0,0|3,0,0]=4 835 B14R2.203 Cc1ccc2ccccc2c1CBr Amb24080215 [0,0,0,1,0,0|3,0,0]=4 836 B14R2.203 Cc1ccc2ccccc2c1CCl Amb2609042 [0,0,0,1,0,0|3,0,0]=4 837 B14R2.203 Cc1ccc2ccccc2c1CN Amb18051856 [0,0,0,1,0,0|3,0,0]=4 838 B14R2.203 ClCc1c(Br)ccc2ccccc12 Amb25995195 [0,0,0,1,0,0|3,0,0]=4 839 B14R2.203 ClCc1c(Cl)ccc2ccccc12 Amb27986203 [0,0,0,1,0,0|3,0,0]=4 840 B14R2.203 ClCc1c(I)ccc2ccccc12 Amb26025835 [0,0,0,1,0,0|3,0,0]=4 841 B14R2.203 Clc1ccc2ccccc2c1CBr Amb27753540 [0,0,0,1,0,0|3,0,0]=4 842 B14R2.203 Fc1ccc2ccccc2c1CBr Amb26654237 [0,0,0,1,0,0|3,0,0]=4 843 B14R2.203 Fc1ccc2ccccc2c1CCl Amb24055306 [0,0,0,1,0,0|3,0,0]=4 844 B14R2.203 NCc1c(Cl)ccc2ccccc12 Amb27803653 [0,0,0,1,0,0|3,0,0]=4 845 B14R2.203 NCc1c(F)ccc2ccccc12 Amb24054596 [0,0,0,1,0,0|3,0,0]=4 846 B14R2.203 NCc1c(I)ccc2ccccc12 Amb25324000 [0,0,0,1,0,0|3,0,0]=4 847 B14R2.203 NCc1c(N)ccc2ccccc12 Amb28243692 [0,0,0,1,0,0|3,0,0]=4 848 B14R2.203 NCc1c(N)ccc2ccccc12 Amb32667593 [0,0,0,1,0,0|3,0,0]=4 849 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1133018 [0,0,0,1,0,0|2,0,1]=4 850 B14R2.203 NCc1c(O)ccc2ccccc12 Amb1993926 [0,0,0,1,0,0|2,0,1]=4 851 B14R2.203 N\C=C1\C(=O)C=Cc2ccccc21 Amb27446516 [0,0,0,1,0,0|2,0,1]=4 852 B14R2.203 Nc1ccc2ccccc2c1CBr Amb27180644 [0,0,0,1,0,0|3,0,0]=4 853 B14R2.203 Nc1ccc2ccccc2c1CO Amb27250669 [0,0,0,1,0,0|3,0,0]=4 854 B14R2.203 O=C1C=Cc2ccccc2\C1=N/O Amb19748272 [0,0,0,1,0,0|3,0,0]=4 855 B14R2.203 OCc1c(Cl)ccc2ccccc12 Amb25808641 [0,0,0,1,0,0|3,0,0]=4 856 B14R2.203 OCc1c(F)ccc2ccccc12 Amb25945307 [0,0,0,1,0,0|3,0,0]=4 857 B14R2.203 OCc1c(I)ccc2ccccc12 Amb27796250 [0,0,0,1,0,0|3,0,0]=4 858 B14R2.203 OCc1c(O)ccc2ccccc12 Amb1111444 [0,0,0,1,0,0|2,0,1]=4 859 B14R2.203 OCc1c(S)ccc2ccccc12 Amb27665549 [0,0,0,1,0,0|2,1,0]=4 860 B14R2.203 Oc1ccc2ccccc2c1CBr Amb25211050 [0,0,0,1,0,0|2,0,1]=4 861 B14R2.203 Oc1ccc2ccccc2c1CCl Amb17477547 [0,0,0,1,0,0|2,0,1]=4 862 B14R2.203 Oc1ccc2ccccc2c1CS Amb32788722 [0,0,0,1,0,0|2,0,1]=4 863 B14R2.280 O=C1C=Cc2ccccc2C=CN1 Amb6359616 [0,0,0,1,0,0|1,0,2]=4 864 B14R2.280 O=C1CCc2ccccc2CCN1 Amb6359613 [0,0,0,1,0,0|1,0,2]=4 865 B14R2.598 C=C1NC(=O)C=C1c2ccccc2 Amb27236869 [0,0,0,1,0,0|1,0,2]=4 866 B14R2.598 CC1=C(c2ccccc2)CC(=O)N1 Amb27401182 [0,0,0,1,0,0|1,0,2]=4 867 B14R2.598 CC1=C(c2ccccc2)NC(=O)N1 Amb28186629 [0,0,0,1,0,0|2,0,1]=4 868 B14R2.598 CC1=C(c2ccccc2)NC(=O)S1 Amb19078561 [0,0,0,1,0,0|1,1,1]=4 869 B14R2.598 CC1CC(=O)CC1c2ccccc2 Amb27409582 [0,0,0,1,0,0|1,0,2]=4 870 B14R2.598 CC1CC(=O)OC1c2ccccc2 Amb27429192 [0,0,0,1,0,0|2,0,1]=4 871 B14R2.598 CC1NC(=O)CC1c2ccccc2 Amb26880847 [0,0,0,1,0,0|1,0,2]=4 872 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,0,0,1,0,0|2,0,1]=4 873 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,0,0,1,0,0|1,0,1]=3 874 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,0,0,1,0,0|2,0,1]=4 875 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,0,0,1,0,0|2,0,1]=4 876 B14R2.598 C[C@@H]1OC(N)=N[C@H]1c2ccccc2 Amb27253548 [0,0,0,1,0,0|2,0,1]=4 877 B14R2.598 C[C@H]1NC(=O)C[C@@H]1c2ccccc2 Amb27978591 [0,0,0,1,0,0|1,0,2]=4 878 B14R2.598 C[C@H]1NC(=O)O[C@@H]1c2ccccc2 Amb26626803 [0,0,0,1,0,0|2,0,1]=4 879 B14R2.598 C[C@H]1NC(=O)O[C@H]1c2ccccc2 Amb541248 [0,0,0,1,0,0|2,0,1]=4 880 B14R2.598 C[C@H]1OC(=O)N[C@H]1c2ccccc2 Amb4090301 [0,0,0,1,0,0|1,0,1]=3 881 B14R2.598 C[C@H]1OC(N)=N[C@H]1c2ccccc2 Amb27629767 [0,0,0,1,0,0|2,0,1]=4 882 B14R2.598 Cc1cc(-c2ccccc2)c(N)o1 Amb27983008 [0,0,0,1,0,0|2,0,1]=4 883 B14R2.598 Cc1cc(-c2ccccc2)n(C)n1 Amb25731051 [0,0,0,1,0,0|3,0,0]=4 884 B14R2.598 Cc1nc(-c2ccccc2)c(C)o1 Amb26588240 [0,0,0,1,0,0|2,0,1]=4 885 B14R2.598 Cc1oc(Cl)nc1-c2ccccc2 Amb27268201 [0,0,0,1,0,0|2,0,1]=4 886 B14R2.598 Cc1oc(I)nc1-c2ccccc2 Amb27214111 [0,0,0,1,0,0|2,0,1]=4 887 B14R2.598 Cc1sc(Br)cc1-c2ccccc2 Amb10600995 [0,0,0,1,0,0|1,1,1]=4 888 B14R2.598 Cc1sc(N)cc1-c2ccccc2 Amb17096063 [0,0,0,1,0,0|1,1,1]=4 889 B14R2.598 Cn1nc(Br)cc1-c2ccccc2 Amb27429069 [0,0,0,1,0,0|3,0,0]=4 890 B14R2.598 Cn1nc(N)cc1-c2ccccc2 Amb18647737 [0,0,0,1,0,0|3,0,0]=4 891 B14R2.598 O=C1C=C(c2ccccc2)C(=O)N1 Amb17334915 [0,0,0,1,0,0|2,0,1]=4 892 B14R2.598 O=C1C=C(c2ccccc2)C(=O)O1 Amb2431774 [0,0,0,1,0,0|1,0,1]=3 893 B14R2.598 O=C1C=C(c2ccccc2)C(O)O1 Amb28422312 [0,0,0,1,0,0|1,0,0]=2 894 B14R2.598 Oc1oc(Br)cc1-c2ccccc2 Amb18732494 [0,0,0,1,0,0|2,0,1]=4 895 B14R2.737 CC1NC(=O)C1Cc2ccccc2 Amb24493901 [0,0,0,1,0,0|1,0,2]=4 896 B14R2.737 CC1NC(=O)C1Sc2ccccc2 Amb27494156 [0,0,0,1,0,0|2,0,1]=4 897 B14R2.737 C[C@@H]1NC(=O)[C@@H]1Sc2ccccc2 Amb28292654 [0,0,0,1,0,0|2,0,1]=4 898 B14R2.737 C[C@H]1NC(=O)[C@@H]1Cc2ccccc2 Amb27484839 [0,0,0,1,0,0|1,0,2]=4 899 B14R2.737 C[C@H]1NC(=O)[C@H]1Sc2ccccc2 Amb27856105 [0,0,0,1,0,0|2,0,1]=4 900 B14R2.2899 O=C(CCc1ccccc1)C2CC2 Amb6303743 [0,0,0,1,0,0|1,0,2]=4 901 B14R2.2899 O=C(COc1ccccc1)C2CC2 Amb33512614 [0,0,0,1,0,0|2,0,1]=4 902 B14R2.2899 O=C(CSc1ccccc1)C2CC2 Amb32682730 [0,0,0,1,0,0|2,0,1]=4 903 B14R2.2899 O=C(\C=C/c1ccncc1)C2CC2 Amb27974604 [0,0,0,1,0,0|2,0,0]=3 904 B14R2.2899 O=C(\C=C\c1ccccc1)C2CC2 Amb1796193 [0,0,0,1,0,0|1,0,0]=2 905 B14R2.2899 O=C(\C=C\c1ccccn1)C2CC2 Amb28249412 [0,0,0,1,0,0|2,0,0]=3 906 B14R2.2899 O=C(\C=C\c1ccncc1)C2CC2 Amb27878882 [0,0,0,1,0,0|2,0,0]=3 907 B14R2.4656 NC1(\C=C\c2ccccc2)CCC1 Amb33081110 [0,0,0,1,0,0|2,0,1]=4 908 B14R2.33858 CCNC(=O)C1Cc2ccccc21 Amb25039759 [0,0,0,1,0,0|1,0,2]=4 909 B14R2.33858 CCOC(=O)C1Cc2ccccc21 Amb27872867 [0,0,0,1,0,0|0,0,2]=3 910 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [0,0,0,0,1,0|0,0,3]=4 911 B12R1.32 CCCC(=O)Cc1ccccc1 Amb3940679 [0,0,0,0,1,0|1,0,1]=3 912 B12R1.32 CCCC(=O)Nc1ccccc1 Amb5794989 [0,0,0,0,1,0|2,0,0]=3 913 B12R1.32 CCCC(=O)Nc1ccccn1 Amb5794992 [0,0,0,0,1,0|3,0,0]=4 914 B12R1.32 CCCC(=O)Nc1ccncc1 Amb3367511 [0,0,0,0,1,0|3,0,0]=4 915 B12R1.32 CCCC(=O)Oc1ccccc1 Amb3103918 [0,0,0,0,1,0|2,0,0]=3 916 B12R1.32 CCC\C(I)=C/c1ccccc1 Amb22546627 [0,0,0,0,1,0|2,0,0]=3 917 B12R1.32 CCNC(=O)C[n+]1ccccc1 Amb26459720 [0,0,0,0,1,0|2,0,1]=4 918 B12R1.32 CCNC(=O)Nc1ccccc1 Amb1233665 [0,0,0,0,1,0|2,0,0]=3 919 B12R1.32 CCNC(=O)Nc1ccccn1 Amb25240072 [0,0,0,0,1,0|3,0,0]=4 920 B12R1.32 CCNC(=O)Nc1cccnc1 Amb13958674 [0,0,0,0,1,0|3,0,0]=4 921 B12R1.32 CCNC(=O)Nc1ccncc1 Amb4012419 [0,0,0,0,1,0|3,0,0]=4 922 B12R1.32 CCNC(=O)Oc1ccccc1 Amb2732291 [0,0,0,0,1,0|2,0,0]=3 923 B12R1.32 CCNC(=S)Nc1ccccc1 Amb2548953 [0,0,0,0,1,0|2,1,0]=4 924 B12R1.32 CCNC(=S)Oc1ccccc1 Amb28077021 [0,0,0,0,1,0|2,1,0]=4 925 B12R1.32 CCOC(=N)Cc1ccccc1 Amb20673132 [0,0,0,0,1,0|1,0,1]=3 926 B12R1.32 CCOC(=N)Cc1ccccc1 Amb2612454 [0,0,0,0,1,0|1,0,1]=3 927 B12R1.32 CCOC(=N)Cc1ccccn1 Amb18792558 [0,0,0,0,1,0|2,0,1]=4 928 B12R1.32 CCOC(=N)Cc1ccncc1 Amb18800815 [0,0,0,0,1,0|2,0,1]=4 929 B12R1.32 CCOC(=O)C[n+]1ccccc1 Amb2794684 [0,0,0,0,1,0|1,0,1]=3 930 B12R1.32 CCOC(=O)C[n+]1ccccc1 Amb3428028 [0,0,0,0,1,0|1,0,1]=3 931 B12R1.32 CCOC(=O)C[n+]1ccccn1 Amb2613481 [0,0,0,0,1,0|2,0,1]=4 932 B12R1.32 CCOC(=O)Cc1ccccc1 Amb3940130 [0,0,0,0,1,0|0,0,1]=2 933 B12R1.32 CCOC(=O)Cc1ccccn1 Amb2724370 [0,0,0,0,1,0|1,0,1]=3 934 B12R1.32 CCOC(=O)Cc1cccnc1 Amb6356440 [0,0,0,0,1,0|1,0,1]=3 935 B12R1.32 CCOC(=O)Cc1cccnn1 Amb23440008 [0,0,0,0,1,0|2,0,1]=4 936 B12R1.32 CCOC(=O)Cc1ccncc1 Amb20621993 [0,0,0,0,1,0|1,0,1]=3 937 B12R1.32 CCOC(=O)Cc1ccncc1 Amb6357492 [0,0,0,0,1,0|1,0,1]=3 938 B12R1.32 CCOC(=O)Cc1ccncn1 Amb22001936 [0,0,0,0,1,0|2,0,1]=4 939 B12R1.32 CCOC(=O)Cc1cnccn1 Amb23399648 [0,0,0,0,1,0|2,0,1]=4 940 B12R1.32 CCOC(=O)Cc1cncnc1 Amb18801018 [0,0,0,0,1,0|2,0,1]=4 941 B12R1.32 CCOC(=O)Cc1ncccn1 Amb17935863 [0,0,0,0,1,0|2,0,1]=4 942 B12R1.32 CCOC(=O)Nc1ccccc1 Amb3101817 [0,0,0,0,1,0|1,0,0]=2 943 B12R1.32 CCOC(=O)Nc1ccccn1 Amb2609641 [0,0,0,0,1,0|2,0,0]=3 944 B12R1.32 CCOC(=O)Nc1cccnc1 Amb6892831 [0,0,0,0,1,0|2,0,0]=3 945 B12R1.32 CCOC(=O)Nc1ccncc1 Amb2692772 [0,0,0,0,1,0|2,0,0]=3 946 B12R1.32 CCOC(=O)Nc1ccncn1 Amb17602618 [0,0,0,0,1,0|3,0,0]=4 947 B12R1.32 CCOC(=O)Nc1cnccn1 Amb35663211 [0,0,0,0,1,0|3,0,0]=4 948 B12R1.32 CCOC(=O)Nc1ncccn1 Amb17862869 [0,0,0,0,1,0|3,0,0]=4 949 B12R1.32 CCOC(=S)Nc1ccccc1 Amb4017698 [0,0,0,0,1,0|1,1,0]=3 950 B12R1.32 CCO\C(C)=N\c1ccccc1 Amb17939699 [0,0,0,0,1,0|2,0,0]=3 951 B12R1.32 CCSC(=N)Nc1ccccc1 Amb4013333 [0,0,0,0,1,0|2,1,0]=4 952 B12R1.32 CCSC(=O)Nc1ccccc1 Amb24310273 [0,0,0,0,1,0|1,1,0]=3 953 B12R1.32 CCSC(=S)Nc1ccccc1 Amb24757680 [0,0,0,0,1,0|1,2,0]=4 954 B12R1.32 CCS\C(N)=N\c1ccccc1 Amb11230603 [0,0,0,0,1,0|2,1,0]=4 955 B12R1.32 CCS\C(N)=N\c1ccccc1 Amb3432767 [0,0,0,0,1,0|2,1,0]=4 956 B12R1.32 CC\N=C(\N)Cc1ccccc1 Amb23569052 [0,0,0,0,1,0|2,0,1]=4 957 B12R1.32 CC\N=C(\N)Oc1ccccc1 Amb25935972 [0,0,0,0,1,0|3,0,0]=4 958 B12R1.32 CNCC(=O)Cc1ccccc1 Amb32954289 [0,0,0,0,1,0|2,0,1]=4 959 B12R1.32 CNCC(=O)Cc1ccccc1 Amb8628392 [0,0,0,0,1,0|2,0,1]=4 960 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6246115 [0,0,0,0,1,0|3,0,0]=4 961 B12R1.32 CNCC(=O)Nc1ccccc1 Amb6893116 [0,0,0,0,1,0|3,0,0]=4 962 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [0,0,0,0,1,0|3,0,0]=4 963 B12R1.32 CNNC(=O)Nc1ccccc1 Amb28252417 [0,0,0,0,1,0|3,0,0]=4 964 B12R1.32 COCC(=O)Cc1ccccc1 Amb9665963 [0,0,0,0,1,0|2,0,1]=4 965 B12R1.32 COCC(=O)Nc1ccccc1 Amb3115714 [0,0,0,0,1,0|3,0,0]=4 966 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [0,0,0,0,1,0|2,0,1]=4 967 B12R1.32 CSCC(=O)Cc1ccccc1 Amb18796330 [0,0,0,0,1,0|2,0,1]=4 968 B12R1.32 CSCC(=O)Nc1ccccc1 Amb2373904 [0,0,0,0,1,0|3,0,0]=4 969 B12R1.32 C\C(=C/c1ccccc1)CCBr Amb18063581 [0,0,0,0,1,0|3,0,0]=4 970 B12R1.32 C\C(=C/c1ccccc1)CCN Amb18063553 [0,0,0,0,1,0|3,0,0]=4 971 B12R1.32 C\C(=C/c1ccccc1)CCO Amb27792195 [0,0,0,0,1,0|3,0,0]=4 972 B12R1.32 C\C(=C/c1ccccc1)CCS Amb33381247 [0,0,0,0,1,0|3,0,0]=4 973 B12R1.32 C\C(=C\c1ccccc1)CCBr Amb27445443 [0,0,0,0,1,0|3,0,0]=4 974 B12R1.32 C\C(=C\c1ccccc1)CCN Amb27843446 [0,0,0,0,1,0|3,0,0]=4 975 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb31280308 [0,0,0,0,1,0|2,0,1]=4 976 B12R1.32 C\C=C\C(=O)Oc1ccccc1 Amb27857446 [0,0,0,0,1,0|2,0,1]=4 977 B12R1.32 NCCC(=O)Cc1ccccc1 Amb32954715 [0,0,0,0,1,0|2,0,1]=4 978 B12R1.32 NCCC(=O)Nc1ccccc1 Amb1125528 [0,0,0,0,1,0|3,0,0]=4 979 B12R1.32 NCCC(=O)Nc1ccccc1 Amb15740909 [0,0,0,0,1,0|3,0,0]=4 980 B12R1.32 NCCC(=O)Oc1ccccc1 Amb17334633 [0,0,0,0,1,0|3,0,0]=4 981 B12R1.32 NCC\C(Br)=C\c1ccccc1 Amb27770057 [0,0,0,0,1,0|3,0,0]=4 982 B12R1.32 NCC\C(Cl)=C/c1ccccc1 Amb27881313 [0,0,0,0,1,0|3,0,0]=4 983 B12R1.32 NCC\C(Cl)=C\c1ccccc1 Amb27843483 [0,0,0,0,1,0|3,0,0]=4 984 B12R1.32 NCOC(=O)Nc1ccccc1 Amb27407731 [0,0,0,0,1,0|2,0,0]=3 985 B12R1.32 O=C(CCBr)Nc1ccccc1 Amb16191990 [0,0,0,0,1,0|3,0,0]=4 986 B12R1.32 O=C(CCCl)Nc1ccccc1 Amb6458951 [0,0,0,0,1,0|3,0,0]=4 987 B12R1.32 O=C(CCCl)Oc1ccccc1 Amb16230794 [0,0,0,0,1,0|3,0,0]=4 988 B12R1.32 O=C(CCO)Nc1ccccc1 Amb9421562 [0,0,0,0,1,0|3,0,0]=4 989 B12R1.32 O=C(CCS)Nc1ccccc1 Amb17305724 [0,0,0,0,1,0|3,0,0]=4 990 B12R1.32 O=C(Cc1ccccc1)NCO Amb2720941 [0,0,0,0,1,0|2,0,1]=4 991 B12R1.32 O=C(Nc1ccccc1)OCCl Amb28436871 [0,0,0,0,1,0|2,0,0]=3 992 B12R1.32 O=C(Nc1ccccn1)OCCl Amb35645061 [0,0,0,0,1,0|3,0,0]=4 993 B12R1.32 O=C(Nc1cccnc1)OCCl Amb35645060 [0,0,0,0,1,0|3,0,0]=4 994 B12R1.32 O=C(Nc1ccncc1)OCCl Amb35645063 [0,0,0,0,1,0|3,0,0]=4 995 B12R1.51 CCNC(=O)\C=C\c1cccs1 Amb17786755 [0,0,0,0,1,0|2,0,0]=3 996 B12R1.51 CCOC(=O)C#Cc1ccco1 Amb27401496 [0,0,0,0,1,0|1,0,2]=4 997 B12R1.51 CCOC(=O)C#Cc1ccoc1 Amb27154129 [0,0,0,0,1,0|1,0,2]=4 998 B12R1.51 CCOC(=O)C#Cc1ccsc1 Amb26940633 [0,0,0,0,1,0|1,0,2]=4 999 B12R1.51 CCOC(=O)CCc1ccco1 Amb6357512 [0,0,0,0,1,0|1,0,2]=4 1000 B12R1.51 CCOC(=O)CCc1ccsc1 Amb22001102 [0,0,0,0,1,0|1,0,2]=4 1001 B12R1.51 CCOC(=O)\C=C\c1ccco1 Amb1033025 [0,0,0,0,1,0|1,0,0]=2 1002 B12R1.51 CCOC(=O)\C=C\c1cccs1 Amb21858181 [0,0,0,0,1,0|1,0,0]=2 1003 B12R1.51 CCOC(=O)\C=C\c1ccsc1 Amb33990712 [0,0,0,0,1,0|1,0,0]=2 1004 B12R1.51 CCOC(=O)\C=C\c1cncs1 Amb33469175 [0,0,0,0,1,0|2,0,0]=3 1005 B12R1.51 CCOC(=O)\C=C\c1cscn1 Amb30594535 [0,0,0,0,1,0|2,0,0]=3 1006 B12R1.51 CCOC(=O)\C=C\c1nccs1 Amb33469170 [0,0,0,0,1,0|2,0,0]=3 1007 B12R1.51 CONC(=O)\C=C\c1cccs1 Amb28063549 [0,0,0,0,1,0|3,0,0]=4 1008 B14R1.520 CCCC(=O)CNCc1ccccc1 Amb33308018 [0,0,0,0,0,1|1,0,2]=4 1009 B14R1.520 CCCC(=O)COCc1ccccc1 Amb19078959 [0,0,0,0,0,1|1,0,2]=4 1010 B14R1.520 CCCC(=O)CSCc1ccccc1 Amb32683101 [0,0,0,0,0,1|1,0,2]=4 1011 B14R1.520 CCCC(=O)NOCc1ccccc1 Amb15742562 [0,0,0,0,0,1|2,0,1]=4 1012 B14R1.520 CCCC(=O)N\C=C/c1ccccc1 Amb27816219 [0,0,0,0,0,1|1,0,0]=2 1013 B14R1.520 CCCC(=O)\C=C\Nc1ccccc1 Amb28040792 [0,0,0,0,0,1|1,0,0]=2 1014 B14R1.520 CCNC(=O)\C=N\Nc1ccccc1 Amb27238604 [0,0,0,0,0,1|2,0,0]=3 1015 B14R1.520 CCNC(=S)N\N=C\c1ccccc1 Amb4801200 [0,0,0,0,0,1|2,1,0]=4 1016 B14R1.520 CCOC(=O)C#CCc1ccccc1 Amb26505964 [0,0,0,0,0,1|0,0,2]=3 1017 B14R1.520 CCOC(=O)C#CCc1ccccn1 Amb27393438 [0,0,0,0,0,1|1,0,2]=4 1018 B14R1.520 CCOC(=O)C#CSc1ccccc1 Amb28124566 [0,0,0,0,0,1|0,0,2]=3 1019 B14R1.520 CCOC(=O)CCCc1ccccc1 Amb3939013 [0,0,0,0,0,1|0,0,2]=3 1020 B14R1.520 CCOC(=O)CCNc1ccccc1 Amb9026190 [0,0,0,0,0,1|0,0,2]=3 1021 B14R1.520 CCOC(=O)CCNc1ccccn1 Amb8395311 [0,0,0,0,0,1|1,0,2]=4 1022 B14R1.520 CCOC(=O)CCOc1ccccc1 Amb6357771 [0,0,0,0,0,1|0,0,2]=3 1023 B14R1.520 CCOC(=O)CCSc1ccccc1 Amb8867120 [0,0,0,0,0,1|0,0,2]=3 1024 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb2720025 [0,0,0,0,0,1|0,0,2]=3 1025 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb6335212 [0,0,0,0,0,1|0,0,2]=3 1026 B14R1.520 CCOC(=O)COCc1ccccc1 Amb7764605 [0,0,0,0,0,1|0,0,2]=3 1027 B14R1.520 CCOC(=O)C\C=C\c1ccccc1 Amb34916573 [0,0,0,0,0,1|0,0,0]=1 1028 B14R1.520 CCOC(=O)C\N=C\c1ccccc1 Amb8394336 [0,0,0,0,0,1|0,0,1]=2 1029 B14R1.520 CCOC(=O)NCCc1ccccc1 Amb6358963 [0,0,0,0,0,1|0,0,2]=3 1030 B14R1.520 CCOC(=O)NOCc1ccccc1 Amb27611822 [0,0,0,0,0,1|1,0,1]=3 1031 B14R1.520 CCOC(=O)N\C=N\c1ccccc1 Amb27957763 [0,0,0,0,0,1|1,0,0]=2 1032 B14R1.520 CCOC(=O)\C=C/Cc1ccccc1 Amb6295788 [0,0,0,0,0,1|0,0,0]=1 1033 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,0,0,0,0,1|0,0,0]=1 1034 B14R1.520 CCO[PH](=O)CNCc1ccccc1 Amb28203972 [0,0,0,0,0,1|1,0,2]=4 1035 B14R1.520 C\C=C\C(=O)\C=C\Nc1ccccc1 Amb27863604 [0,0,0,0,0,1|1,0,1]=3 1036 B11R1.28 BrCC\C=C\c1ccccc1 Amb17140564 [2,0,0,0,0,0|1,0,1]=4 1037 B11R1.28 Br\C=C\C=C\c1ccccc1 Amb27963876 [2,0,0,0,0,0|1,0,1]=4 1038 B11R1.28 CCC\C=C\c1ccccc1 Amb4017967 [2,0,0,0,0,0|0,0,1]=3 1039 B11R1.28 CCC\C=N\c1ccccc1 Amb16231172 [2,0,0,0,0,0|1,0,1]=4 1040 B11R1.28 CCC\N=C\c1ccccc1 Amb4605889 [2,0,0,0,0,0|1,0,1]=4 1041 B11R1.28 CCOCCc1ccccc1 Amb4035236 [2,0,0,0,0,0|0,0,2]=4 1042 B11R1.28 CCOCOc1ccccc1 Amb28388170 [2,0,0,0,0,0|1,0,1]=4 1043 B11R1.28 CCONCc1ccccc1 Amb25151184 [2,0,0,0,0,0|1,0,1]=4 1044 B11R1.28 CCO\C=C\c1ccccc1 Amb4020955 [2,0,0,0,0,0|0,0,0]=2 1045 B11R1.28 CCO\C=C\c1ccncc1 Amb27253748 [2,0,0,0,0,0|1,0,0]=3 1046 B11R1.28 CCO\C=N\c1ccccc1 Amb9786981 [2,0,0,0,0,0|1,0,0]=3 1047 B11R1.28 CCO\C=N\c1cccnc1 Amb28253382 [2,0,0,0,0,0|2,0,0]=4 1048 B11R1.28 CCO\C=N\c1ccncc1 Amb33140969 [2,0,0,0,0,0|2,0,0]=4 1049 B11R1.28 CCO\N=C/c1ccccn1 Amb26480023 [2,0,0,0,0,0|2,0,0]=4 1050 B11R1.28 CCO\N=C\c1cccnc1 Amb22169409 [2,0,0,0,0,0|2,0,0]=4 1051 B11R1.28 CCO\N=C\c1ccncc1 Amb26971987 [2,0,0,0,0,0|2,0,0]=4 1052 B11R1.28 CC\C=C\Cc1ccncc1 Amb27230808 [2,0,0,0,0,0|1,0,1]=4 1053 B11R1.28 CC\C=N\Nc1ccccc1 Amb27258240 [2,0,0,0,0,0|2,0,0]=4 1054 B11R1.28 CNC\C=C\c1ccccc1 Amb2114273 [2,0,0,0,0,0|1,0,1]=4 1055 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [2,0,0,0,0,0|1,0,0]=3 1056 B11R1.28 CSC\C=C\c1ccccc1 Amb27261145 [2,0,0,0,0,0|0,1,1]=4 1057 B11R1.28 C\C=C\C=C\c1ccccc1 Amb27870048 [2,0,0,0,0,0|0,0,1]=3 1058 B11R1.28 ClCC\C=C\c1ccccc1 Amb17232628 [2,0,0,0,0,0|1,0,1]=4 1059 B11R1.28 ClCO\N=C\c1ccccc1 Amb25838175 [2,0,0,0,0,0|2,0,0]=4 1060 B11R1.28 ClC\C=C\Sc1ccccc1 Amb27452187 [2,0,0,0,0,0|2,0,0]=4 1061 B11R1.28 Cl\C=C\C=C\c1ccccc1 Amb8392466 [2,0,0,0,0,0|1,0,1]=4 1062 B11R1.28 ICC\C=C\c1ccccc1 Amb27261633 [2,0,0,0,0,0|1,0,1]=4 1063 B11R1.28 IC\C=C\Cc1ccccc1 Amb28428997 [2,0,0,0,0,0|1,0,1]=4 1064 B11R1.28 NCC\C=C/c1ccccc1 Amb27254115 [2,0,0,0,0,0|1,0,1]=4 1065 B11R1.28 NCC\C=C\c1ccccc1 Amb17138419 [2,0,0,0,0,0|1,0,1]=4 1066 B11R1.28 NC\C=C\Cc1ccccc1 Amb32951245 [2,0,0,0,0,0|1,0,1]=4 1067 B11R1.28 NOC\C=C\c1ccccc1 Amb33136389 [2,0,0,0,0,0|1,0,1]=4 1068 B11R1.28 N\C=C\C=C\c1ccccc1 Amb27393486 [2,0,0,0,0,0|1,0,1]=4 1069 B11R1.28 N\N=C\C=C\c1ccccc1 Amb27764571 [2,0,0,0,0,0|2,0,0]=4 1070 B11R1.28 OCC\C=C\c1ccccc1 Amb33213896 [2,0,0,0,0,0|1,0,1]=4 1071 B11R1.28 OC\C=C\Cc1ccccc1 Amb32951814 [2,0,0,0,0,0|1,0,1]=4 1072 B11R1.28 OC\C=C\Sc1ccccc1 Amb27164022 [2,0,0,0,0,0|2,0,0]=4 1073 B11R1.28 O\C=C\C=C\c1ccccc1 Amb27970649 [2,0,0,0,0,0|1,0,1]=4 1074 B11R1.28 O\N=C\C=C/c1ccccc1 Amb24668019 [2,0,0,0,0,0|2,0,0]=4 1075 B11R1.28 O\N=C\C=C\c1ccccc1 Amb28366863 [2,0,0,0,0,0|2,0,0]=4 1076 B11R1.28 SCC\C=C\c1ccccc1 Amb33081762 [2,0,0,0,0,0|1,0,1]=4 1077 B11R1.91 C=C(C)\C=C\c1ccccc1 Amb22546632 [2,0,0,0,0,0|1,0,0]=3 1078 B11R1.91 CC(=O)C#Cc1ccccc1 Amb6336493 [2,0,0,0,0,0|0,0,2]=4 1079 B11R1.91 CC(=O)CCc1ccccc1 Amb4605983 [2,0,0,0,0,0|0,0,2]=4 1080 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [2,0,0,0,0,0|1,0,1]=4 1081 B11R1.91 CC(=O)COc1ccccc1 Amb8515312 [2,0,0,0,0,0|1,0,1]=4 1082 B11R1.91 CC(=O)CSc1ccccc1 Amb3836103 [2,0,0,0,0,0|1,0,1]=4 1083 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [2,0,0,0,0,0|1,0,1]=4 1084 B11R1.91 CC(=O)NNc1ccccc1 Amb4081010 [2,0,0,0,0,0|2,0,0]=4 1085 B11R1.91 CC(=O)OCc1ccccc1 Amb8513061 [2,0,0,0,0,0|1,0,1]=4 1086 B11R1.91 CC(=O)O[Hg]c1ccccc1 Amb8385173 [2,0,0,0,0,0|2,0,0]=4 1087 B11R1.91 CC(=O)SCc1ccccc1 Amb26888160 [2,0,0,0,0,0|1,0,1]=4 1088 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [2,0,0,0,0,0|0,0,0]=2 1089 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb33716963 [2,0,0,0,0,0|0,0,0]=2 1090 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [2,0,0,0,0,0|1,0,0]=3 1091 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb32652097 [2,0,0,0,0,0|1,0,0]=3 1092 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb33223775 [2,0,0,0,0,0|1,0,0]=3 1093 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb33359225 [2,0,0,0,0,0|1,0,0]=3 1094 B11R1.91 CC(=O)\C=C\c1ccncn1 Amb33359235 [2,0,0,0,0,0|2,0,0]=4 1095 B11R1.91 CC(=O)\C=C\c1cnccn1 Amb35601036 [2,0,0,0,0,0|2,0,0]=4 1096 B11R1.91 CC(=O)\C=C\c1cncnc1 Amb32876838 [2,0,0,0,0,0|2,0,0]=4 1097 B11R1.91 CC(=O)\C=C\c1ncccn1 Amb26488880 [2,0,0,0,0,0|2,0,0]=4 1098 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [2,0,0,0,0,0|2,0,0]=4 1099 B11R1.91 CC(Br)\C=C\c1ccccc1 Amb27401147 [2,0,0,0,0,0|1,0,1]=4 1100 B11R1.91 CC(C)=CCc1ccccc1 Amb2720924 [2,0,0,0,0,0|1,0,1]=4 1101 B11R1.91 CC(C)=COc1ccccc1 Amb28182600 [2,0,0,0,0,0|2,0,0]=4 1102 B11R1.91 CC(C)=CSc1ccccc1 Amb27767952 [2,0,0,0,0,0|2,0,0]=4 1103 B11R1.91 CC(C)\C=C/c1ccccc1 Amb22546593 [2,0,0,0,0,0|1,0,1]=4 1104 B11R1.91 CC(C)\C=C\c1ccccc1 Amb33620440 [2,0,0,0,0,0|1,0,1]=4 1105 B11R1.91 CC(N)\C=C\c1ccccc1 Amb18124854 [2,0,0,0,0,0|1,0,1]=4 1106 B11R1.91 CC(O)\C=C\c1ccccc1 Amb17593695 [2,0,0,0,0,0|0,0,2]=4 1107 B11R1.91 CS(=O)\N=C\c1ccccc1 Amb35681663 [2,0,0,0,0,0|2,0,0]=4 1108 B11R1.91 C[C@@H](N)\C=C\c1ccccc1 Amb33083236 [2,0,0,0,0,0|1,0,1]=4 1109 B11R1.91 C[C@@H](O)\C=C\c1ccccc1 Amb32954507 [2,0,0,0,0,0|0,0,2]=4 1110 B11R1.91 C[C@H](N)\C=C\c1ccccc1 Amb32954166 [2,0,0,0,0,0|1,0,1]=4 1111 B11R1.91 C[C@H](O)\C=C\c1ccccc1 Amb27405101 [2,0,0,0,0,0|0,0,2]=4 1112 B11R1.91 N=C(N)\C=C\c1ccccc1 Amb22756994 [2,0,0,0,0,0|2,0,0]=4 1113 B11R1.91 NC(=O)\C=C/c1ccccc1 Amb4420621 [2,0,0,0,0,0|1,0,0]=3 1114 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [2,0,0,0,0,0|2,0,0]=4 1115 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb33719420 [2,0,0,0,0,0|1,0,0]=3 1116 B11R1.91 NC(=O)\C=C\c1ccccc1 Amb8513084 [2,0,0,0,0,0|1,0,0]=3 1117 B11R1.91 NC(=O)\C=C\c1ccccn1 Amb25887084 [2,0,0,0,0,0|2,0,0]=4 1118 B11R1.91 NC(=O)\C=C\c1cccnc1 Amb33854872 [2,0,0,0,0,0|2,0,0]=4 1119 B11R1.91 NC(=O)\C=C\c1ccncc1 Amb26859260 [2,0,0,0,0,0|2,0,0]=4 1120 B11R1.91 NC(=O)\N=C\c1ccccc1 Amb28364091 [2,0,0,0,0,0|2,0,0]=4 1121 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [2,0,0,0,0,0|1,1,0]=4 1122 B11R1.91 O=C(Cl)\C=C\c1ccccc1 Amb2792900 [2,0,0,0,0,0|1,0,0]=3 1123 B11R1.91 O=C(Cl)\C=C\c1cccnc1 Amb6307270 [2,0,0,0,0,0|2,0,0]=4 1124 B11R1.91 O=C(O)C#Cc1ccccc1 Amb6364732 [2,0,0,0,0,0|0,0,2]=4 1125 B11R1.91 O=C(O)CCc1ccccc1 Amb6356505 [2,0,0,0,0,0|0,0,2]=4 1126 B11R1.91 O=C(O)CNc1ccccc1 Amb840513 [2,0,0,0,0,0|1,0,1]=4 1127 B11R1.91 O=C(O)COc1ccccc1 Amb1213413 [2,0,0,0,0,0|1,0,1]=4 1128 B11R1.91 O=C(O)COc1ccccc1 Amb22274444 [2,0,0,0,0,0|1,0,1]=4 1129 B11R1.91 O=C(O)CSc1ccccc1 Amb1038999 [2,0,0,0,0,0|1,0,1]=4 1130 B11R1.91 O=C(O)\C=C/c1ccccc1 Amb26880208 [2,0,0,0,0,0|0,0,0]=2 1131 B11R1.91 O=C(O)\C=C/c1ccccn1 Amb10071558 [2,0,0,0,0,0|1,0,0]=3 1132 B11R1.91 O=C(O)\C=C/c1cccnc1 Amb25378742 [2,0,0,0,0,0|1,0,0]=3 1133 B11R1.91 O=C(O)\C=C/c1ccncc1 Amb20622011 [2,0,0,0,0,0|1,0,0]=3 1134 B11R1.91 O=C(O)\C=C/c1cncnc1 Amb27975406 [2,0,0,0,0,0|2,0,0]=4 1135 B11R1.91 O=C(O)\C=C\N1C=CC=CC1 Amb22015329 [2,0,0,0,0,0|1,0,1]=4 1136 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb33719192 [2,0,0,0,0,0|0,0,0]=2 1137 B11R1.91 O=C(O)\C=C\c1ccccc1 Amb6456608 [2,0,0,0,0,0|0,0,0]=2 1138 B11R1.91 O=C(O)\C=C\c1ccccn1 Amb2690432 [2,0,0,0,0,0|1,0,0]=3 1139 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb2690433 [2,0,0,0,0,0|1,0,0]=3 1140 B11R1.91 O=C(O)\C=C\c1cccnc1 Amb33718815 [2,0,0,0,0,0|1,0,0]=3 1141 B11R1.91 O=C(O)\C=C\c1cccnn1 Amb18125070 [2,0,0,0,0,0|2,0,0]=4 1142 B11R1.91 O=C(O)\C=C\c1ccncc1 Amb1107607 [2,0,0,0,0,0|1,0,0]=3 1143 B11R1.91 O=C(O)\C=C\c1ccncn1 Amb25337419 [2,0,0,0,0,0|2,0,0]=4 1144 B11R1.91 O=C(O)\C=C\c1ccnnc1 Amb18125071 [2,0,0,0,0,0|2,0,0]=4 1145 B11R1.91 O=C(O)\C=C\c1cnccn1 Amb24082749 [2,0,0,0,0,0|2,0,0]=4 1146 B11R1.91 O=C(O)\C=C\c1cncnc1 Amb9780324 [2,0,0,0,0,0|2,0,0]=4 1147 B11R1.91 O=C(O)\C=C\c1ncccn1 Amb17593721 [2,0,0,0,0,0|2,0,0]=4 1148 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb33513073 [2,0,0,0,0,0|0,0,1]=3 1149 B11R1.91 O=C([O-])\C=C\c1ccccc1 Amb6383246 [2,0,0,0,0,0|0,0,1]=3 1150 B11R1.91 O=C([O-])\C=C\c1cccnc1 Amb33512942 [2,0,0,0,0,0|1,0,1]=4 1151 B11R1.91 O=S(O)\C=C\c1ccccc1 Amb32753683 [2,0,0,0,0,0|1,0,0]=3 1152 B11R1.91 O=S([O-])\C=C\c1ccccc1 Amb26016414 [2,0,0,0,0,0|1,0,1]=4 1153 B11R1.91 O=[N+]([O-])\C=C/c1ccccc1 Amb4066298 [2,0,0,0,0,0|1,0,1]=4 1154 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb33719275 [2,0,0,0,0,0|1,0,1]=4 1155 B11R1.91 O=[N+]([O-])\C=C\c1ccccc1 Amb8396046 [2,0,0,0,0,0|1,0,1]=4 1156 B11R1.91 OB(O)\C=C\c1ccccc1 Amb2447227 [2,0,0,0,0,0|1,0,1]=4 1157 B13R1.6 CCO\N=C\Nc1cccc(Cl)c1 Amb27223973 [1,1,0,0,0,0|2,0,0]=4 1158 B13R1.9 CO\N=C\C=C\c1ccc(Cl)cc1 Amb28051408 [1,1,0,0,0,0|2,0,0]=4 1159 B13R1.9 NC\C=C\C=C\c1ccc(F)cc1 Amb33202421 [1,1,0,0,0,0|2,0,0]=4 1160 B13R1.9 OC\C=C\C=C\c1ccc(F)cc1 Amb33079139 [1,1,0,0,0,0|2,0,0]=4 1161 B13R1.24 CCCN\C=C(/N)c1ccccc1 Amb27165205 [1,1,0,0,0,0|2,0,0]=4 1162 B13R1.24 CCN\C=C/C(=O)c1ccccc1 Amb27415685 [1,1,0,0,0,0|1,0,0]=3 1163 B13R1.24 CCOCNC(=O)c1ccccc1 Amb24072678 [1,1,0,0,0,0|1,0,1]=4 1164 B13R1.24 CCO\C=C\C(=O)c1ccccc1 Amb33291556 [1,1,0,0,0,0|0,0,0]=2 1165 B13R1.24 CCO\C=C\C(=O)c1ccccn1 Amb33355208 [1,1,0,0,0,0|1,0,0]=3 1166 B13R1.24 CCO\C=C\C(=O)c1cccnc1 Amb33355207 [1,1,0,0,0,0|1,0,0]=3 1167 B13R1.24 CCO\C=C\C(=O)c1ccncc1 Amb33355206 [1,1,0,0,0,0|1,0,0]=3 1168 B13R1.24 CCO\C=C\C(=O)c1ccncn1 Amb33355631 [1,1,0,0,0,0|2,0,0]=4 1169 B13R1.24 CCO\C=C\C(=O)c1cnccn1 Amb33355209 [1,1,0,0,0,0|2,0,0]=4 1170 B13R1.24 C\C(=C\C=C\CO)c1ccccc1 Amb27753034 [1,1,0,0,0,0|2,0,0]=4 1171 B13R1.28 BrCCOC\C=C\c1ccccc1 Amb24113552 [1,1,0,0,0,0|0,0,1]=3 1172 B13R1.28 CCCNC\C=C\c1ccccc1 Amb20673523 [1,1,0,0,0,0|1,0,1]=4 1173 B13R1.28 CCCNC\C=C\c1ccccc1 Amb838094 [1,1,0,0,0,0|1,0,1]=4 1174 B13R1.28 CCNCC\C=C/c1ccccc1 Amb17142949 [1,1,0,0,0,0|1,0,1]=4 1175 B13R1.28 NCCSC\C=C\c1ccccc1 Amb9727179 [1,1,0,0,0,0|0,1,1]=4 1176 B13R1.28 OCC=C=C\C=C\c1ccccc1 Amb27651709 [1,1,0,0,0,0|1,0,1]=4 1177 B13R1.28 OCCNC\C=C\c1ccccc1 Amb1926880 [1,1,0,0,0,0|1,0,1]=4 1178 B13R1.28 OCCNC\C=C\c1ccccc1 Amb6864512 [1,1,0,0,0,0|1,0,1]=4 1179 B13R1.44 CC(=C\c1ccccc1)\C=C\CCl Amb27955281 [1,1,0,0,0,0|2,0,0]=4 1180 B13R1.44 CC(\C=C\CN)=C/c1ccccc1 Amb33380902 [1,1,0,0,0,0|2,0,0]=4 1181 B13R1.44 CC(\C=C\CO)=C/c1ccccc1 Amb32954083 [1,1,0,0,0,0|2,0,0]=4 1182 B13R1.44 CCOCC(=O)Nc1ccccc1 Amb2662084 [1,1,0,0,0,0|1,0,1]=4 1183 B13R1.44 CCONC(=O)Nc1ccccc1 Amb2818933 [1,1,0,0,0,0|2,0,0]=4 1184 B13R1.44 CCONC(=S)Nc1ccccc1 Amb25733078 [1,1,0,0,0,0|2,0,0]=4 1185 B13R1.337 CC(=O)OC\C=C\c1ccccc1 Amb30640111 [1,1,0,0,0,0|0,0,2]=4 1186 B13R1.337 CC(=O)\C=C\C=C\c1ccccc1 Amb27605732 [1,1,0,0,0,0|1,0,1]=4 1187 B13R1.337 CC(C)NC\C=C\c1ccccc1 Amb19890403 [1,1,0,0,0,0|1,0,1]=4 1188 B13R1.337 CC(C)NC\C=C\c1ccccc1 Amb2118507 [1,1,0,0,0,0|1,0,1]=4 1189 B13R1.337 CC(N)CC\C=C\c1ccccc1 Amb32954844 [1,1,0,0,0,0|1,0,1]=4 1190 B13R1.337 CC(N)\C=C\C=C\c1ccccc1 Amb27986103 [1,1,0,0,0,0|1,0,0]=3 1191 B13R1.337 CC(O)CC\C=C\c1ccccc1 Amb18808901 [1,1,0,0,0,0|1,0,1]=4 1192 B13R1.337 CS(=O)\C=C\C=C\c1ccccc1 Amb2612174 [1,1,0,0,0,0|2,0,0]=4 1193 B13R1.337 C[C@@H](N)CC\C=C\c1ccccc1 Amb33080794 [1,1,0,0,0,0|1,0,1]=4 1194 B13R1.337 C[C@@H](O)C#C\C=C\c1ccccc1 Amb27617823 [1,1,0,0,0,0|1,0,1]=4 1195 B13R1.337 C[C@@H](O)CC\C=C\c1ccccc1 Amb33080791 [1,1,0,0,0,0|1,0,1]=4 1196 B13R1.337 C[C@H](N)CC\C=C\c1ccccc1 Amb33080760 [1,1,0,0,0,0|1,0,1]=4 1197 B13R1.337 C[C@H](O)CC\C=C\c1ccccc1 Amb33081535 [1,1,0,0,0,0|1,0,1]=4 1198 B13R1.718 C\C(=C/C=C/c1ccccc1)CBr Amb28140679 [1,1,0,0,0,0|2,0,0]=4 1199 B13R1.718 C\C(=C/C=C/c1ccccc1)CCl Amb27455495 [1,1,0,0,0,0|2,0,0]=4 1200 B13R1.11 C=C(NC(=O)CC)c1ccccc1 Amb26619762 [1,1,0,0,0,0|1,0,0]=3 1201 B13R1.11 C=CC(=O)\C=C(\N)c1ccccc1 Amb27984681 [1,1,0,0,0,0|0,0,2]=4 1202 B13R1.11 CCC(=O)CC(=O)c1ccccc1 Amb7766301 [1,1,0,0,0,0|0,0,1]=3 1203 B13R1.11 CCC(=O)CC(=O)c1ccccn1 Amb7766277 [1,1,0,0,0,0|1,0,1]=4 1204 B13R1.11 CCC(=O)CC(=O)c1cccnc1 Amb7766279 [1,1,0,0,0,0|1,0,1]=4 1205 B13R1.11 CCC(=O)CC(=O)c1ccncc1 Amb7761964 [1,1,0,0,0,0|1,0,1]=4 1206 B13R1.11 CCC(=O)CC(C)c1ccccc1 Amb17594493 [1,1,0,0,0,0|0,0,2]=4 1207 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [1,1,0,0,0,0|1,0,1]=4 1208 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [1,1,0,0,0,0|1,0,0]=3 1209 B13R1.11 CCC(=O)OC(C)c1ccccc1 Amb6357162 [1,1,0,0,0,0|1,0,1]=4 1210 B13R1.11 CCC(=O)\C=C(/C)c1ccccc1 Amb27802793 [1,1,0,0,0,0|0,0,0]=2 1211 B13R1.11 CCC(=O)\C=C(\N)c1ccccc1 Amb27252260 [1,1,0,0,0,0|0,0,0]=2 1212 B13R1.11 CCS(=O)\N=C(\C)c1ccccc1 Amb35726570 [1,1,0,0,0,0|2,0,0]=4 1213 B13R1.11 CC[C@H](O)\C=C(\C)c1ccccc1 Amb27255183 [1,1,0,0,0,0|0,0,2]=4 1214 B13R1.11 CC\C(N)=N\C(=O)c1ccccc1 Amb27232979 [1,1,0,0,0,0|2,0,0]=4 1215 B13R1.11 CC\C(N)=N\C(=S)c1ccccc1 Amb27407020 [1,1,0,0,0,0|2,0,0]=4 1216 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [1,1,0,0,0,0|1,0,1]=4 1217 B13R1.11 CNC(=O)NC(=O)c1ccccc1 Amb28287343 [1,1,0,0,0,0|2,0,0]=4 1218 B13R1.11 CNC(=O)\C=C(/C)c1ccccc1 Amb27860376 [1,1,0,0,0,0|1,0,0]=3 1219 B13R1.11 CNC(=O)\C=C(\C)c1ccncc1 Amb27256011 [1,1,0,0,0,0|2,0,0]=4 1220 B13R1.11 CNC(=O)\C=C(\O)c1ccccc1 Amb8492599 [1,1,0,0,0,0|1,0,0]=3 1221 B13R1.11 CNC(=O)\C=C(\S)c1ccccc1 Amb27464395 [1,1,0,0,0,0|1,0,0]=3 1222 B13R1.11 CN\C(C)=C/C(=S)c1ccccc1 Amb27667972 [1,1,0,0,0,0|2,0,0]=4 1223 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [1,1,0,0,0,0|0,0,1]=3 1224 B13R1.11 COC(=O)CC(=O)c1ccccn1 Amb21857821 [1,1,0,0,0,0|1,0,1]=4 1225 B13R1.11 COC(=O)CC(=O)c1cccnc1 Amb2691246 [1,1,0,0,0,0|1,0,1]=4 1226 B13R1.11 COC(=O)CC(=O)c1ccncc1 Amb33527282 [1,1,0,0,0,0|1,0,1]=4 1227 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [1,1,0,0,0,0|0,0,2]=4 1228 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb1221582 [1,1,0,0,0,0|0,0,2]=4 1229 B13R1.11 COC(=O)CC(N)c1ccccc1 Amb2371447 [1,1,0,0,0,0|0,0,2]=4 1230 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [1,1,0,0,0,0|0,0,2]=4 1231 B13R1.11 COC(=O)CS(=O)c1ccccc1 Amb2774190 [1,1,0,0,0,0|1,0,1]=4 1232 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [1,1,0,0,0,0|0,0,2]=4 1233 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [1,1,0,0,0,0|0,0,2]=4 1234 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [1,1,0,0,0,0|0,0,2]=4 1235 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb17617178 [1,1,0,0,0,0|0,0,2]=4 1236 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [1,1,0,0,0,0|0,0,2]=4 1237 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb33801673 [1,1,0,0,0,0|0,0,2]=4 1238 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [1,1,0,0,0,0|0,0,2]=4 1239 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [1,1,0,0,0,0|1,0,0]=3 1240 B13R1.11 COC(=O)NC(O)c1ccccc1 Amb27413659 [1,1,0,0,0,0|1,0,1]=4 1241 B13R1.11 COC(=O)OC(=O)c1ccccn1 Amb32658041 [1,1,0,0,0,0|2,0,0]=4 1242 B13R1.11 COC(=O)\C=C(/C)c1ccccn1 Amb33529166 [1,1,0,0,0,0|1,0,0]=3 1243 B13R1.11 COC(=O)\C=C(/C)c1cccnc1 Amb33551487 [1,1,0,0,0,0|1,0,0]=3 1244 B13R1.11 COC(=O)\C=C(/C)c1ccncc1 Amb32644786 [1,1,0,0,0,0|1,0,0]=3 1245 B13R1.11 COC(=O)\C=C(/C)c1cnccn1 Amb33528493 [1,1,0,0,0,0|2,0,0]=4 1246 B13R1.11 COC(=O)\C=C(/N)c1ccccc1 Amb26953655 [1,1,0,0,0,0|0,0,0]=2 1247 B13R1.11 COC(=O)\C=C(\C)c1ccccc1 Amb4035457 [1,1,0,0,0,0|0,0,0]=2 1248 B13R1.11 COC(=O)\C=C(\C)c1ccccn1 Amb28075561 [1,1,0,0,0,0|1,0,0]=3 1249 B13R1.11 COC(=O)\C=C(\C)c1cccnc1 Amb25191857 [1,1,0,0,0,0|1,0,0]=3 1250 B13R1.11 COC(=O)\C=C(\C)c1ccncc1 Amb26571261 [1,1,0,0,0,0|1,0,0]=3 1251 B13R1.11 COC(=O)\C=C(\C)c1cnccn1 Amb26464298 [1,1,0,0,0,0|2,0,0]=4 1252 B13R1.11 COC(=O)\C=C(\N)c1cccnc1 Amb27191681 [1,1,0,0,0,0|1,0,0]=3 1253 B13R1.11 COC(=S)NC(=O)c1ccccc1 Amb10553666 [1,1,0,0,0,0|1,1,0]=4 1254 B13R1.11 CO\C(C)=C\C(=O)c1ccccc1 Amb25988190 [1,1,0,0,0,0|1,0,0]=3 1255 B13R1.11 C\C(=C/C(=O)c1ccccc1)CCl Amb28044413 [1,1,0,0,0,0|2,0,0]=4 1256 B13R1.11 C\C(=C\C(=O)NO)c1ccccc1 Amb27982484 [1,1,0,0,0,0|2,0,0]=4 1257 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [1,1,0,0,0,0|2,0,0]=4 1258 B13R1.11 NCC(=S)\C=C(\N)c1ccccc1 Amb24664310 [1,1,0,0,0,0|1,1,0]=4 1259 B13R1.11 N\C(=C/C(=O)CO)c1ccccc1 Amb27248345 [1,1,0,0,0,0|1,0,0]=3 1260 B13R1.11 N\C(=C\C(=O)CO)c1ccccc1 Amb27436162 [1,1,0,0,0,0|1,0,0]=3 1261 B13R1.11 N\C(=C\C(=O)c1ccccc1)CO Amb27493445 [1,1,0,0,0,0|2,0,0]=4 1262 B13R1.11 O=C(CCl)NC(=O)c1ccccc1 Amb6374171 [1,1,0,0,0,0|2,0,0]=4 1263 B13R1.11 O=C(CCl)NC(=S)c1ccccc1 Amb22285382 [1,1,0,0,0,0|2,0,0]=4 1264 B13R1.11 O=C(CO)NC(=O)c1ccccc1 Amb1109639 [1,1,0,0,0,0|2,0,0]=4 1265 B13R1.11 O=C(\C=C(/Cl)CCl)c1ccccc1 Amb25780102 [1,1,0,0,0,0|2,0,0]=4 1266 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CBr Amb33335990 [1,1,0,0,0,0|2,0,0]=4 1267 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CCl Amb33260281 [1,1,0,0,0,0|2,0,0]=4 1268 B13R1.14 C=C(\C=C\c1ccc(F)cc1)CN Amb33202422 [1,1,0,0,0,0|2,0,0]=4 1269 B13R1.14 C=CC(=O)\C=C\c1ccc(Br)cc1 Amb33503229 [1,1,0,0,0,0|0,0,2]=4 1270 B13R1.14 C=CC(=O)\C=C\c1ccc(C)cc1 Amb33503115 [1,1,0,0,0,0|0,0,2]=4 1271 B13R1.14 C=CC(=O)\C=C\c1ccc(Cl)cc1 Amb20248598 [1,1,0,0,0,0|0,0,2]=4 1272 B13R1.14 C=CC(=O)\C=C\c1ccc(F)cc1 Amb33503230 [1,1,0,0,0,0|0,0,2]=4 1273 B13R1.14 CCC(=O)CCc1ccc(Br)cc1 Amb9031662 [1,1,0,0,0,0|0,0,2]=4 1274 B13R1.14 CCC(=O)CCc1ccc(C)cc1 Amb9031666 [1,1,0,0,0,0|0,0,2]=4 1275 B13R1.14 CCC(=O)CCc1ccc(Cl)cc1 Amb9031684 [1,1,0,0,0,0|0,0,2]=4 1276 B13R1.14 CCC(=O)CCc1ccc(F)cc1 Amb8869667 [1,1,0,0,0,0|0,0,2]=4 1277 B13R1.14 CCC(=O)CCc1ccc(O)cc1 Amb22547635 [1,1,0,0,0,0|0,0,2]=4 1278 B13R1.14 CCC(=O)CNc1ccc(C)cc1 Amb28048870 [1,1,0,0,0,0|1,0,1]=4 1279 B13R1.14 CCC(=O)CSc1ccc(Br)cc1 Amb32682959 [1,1,0,0,0,0|1,0,1]=4 1280 B13R1.14 CCC(=O)CSc1ccc(C)cc1 Amb18330490 [1,1,0,0,0,0|1,0,1]=4 1281 B13R1.14 CCC(=O)CSc1ccc(Cl)cc1 Amb19415865 [1,1,0,0,0,0|1,0,1]=4 1282 B13R1.14 CCC(=O)CSc1ccc(F)cc1 Amb19083508 [1,1,0,0,0,0|1,0,1]=4 1283 B13R1.14 CCC(=O)NCc1ccc(Br)cc1 Amb27414548 [1,1,0,0,0,0|1,0,1]=4 1284 B13R1.14 CCC(=O)NCc1ccc(C)cc1 Amb2660843 [1,1,0,0,0,0|1,0,1]=4 1285 B13R1.14 CCC(=O)NCc1ccc(Cl)cc1 Amb3094823 [1,1,0,0,0,0|1,0,1]=4 1286 B13R1.14 CCC(=O)NCc1ccc(F)cc1 Amb17790296 [1,1,0,0,0,0|1,0,1]=4 1287 B13R1.14 CCC(=O)NCc1ccc(N)cc1 Amb17138876 [1,1,0,0,0,0|1,0,1]=4 1288 B13R1.14 CCC(=O)NNc1ccc(Br)cc1 Amb6386297 [1,1,0,0,0,0|2,0,0]=4 1289 B13R1.14 CCC(=O)NNc1ccc(C)cc1 Amb3531027 [1,1,0,0,0,0|2,0,0]=4 1290 B13R1.14 CCC(=O)NNc1ccc(F)cc1 Amb28294048 [1,1,0,0,0,0|2,0,0]=4 1291 B13R1.14 CCC(=O)\C=C\c1ccc(C)cc1 Amb26570561 [1,1,0,0,0,0|0,0,0]=2 1292 B13R1.14 CCC(N)\C=C\c1ccc(C)cc1 Amb26609099 [1,1,0,0,0,0|1,0,1]=4 1293 B13R1.14 CCC(O)\C=C\c1ccc(N)cc1 Amb35622610 [1,1,0,0,0,0|0,0,2]=4 1294 B13R1.14 CCS(=O)\N=C\c1ccc(Br)cc1 Amb35726566 [1,1,0,0,0,0|2,0,0]=4 1295 B13R1.14 CCS(=O)\N=C\c1ccc(C)cc1 Amb35734107 [1,1,0,0,0,0|2,0,0]=4 1296 B13R1.14 CCS(=O)\N=C\c1ccc(Cl)cc1 Amb35726567 [1,1,0,0,0,0|2,0,0]=4 1297 B13R1.14 CCS(=O)\N=C\c1ccc(F)cc1 Amb35726555 [1,1,0,0,0,0|2,0,0]=4 1298 B13R1.14 CCS(=O)\N=C\c1ccc(I)cc1 Amb35681699 [1,1,0,0,0,0|2,0,0]=4 1299 B13R1.14 CCS(=O)\N=C\c1ccc(O)cc1 Amb35726563 [1,1,0,0,0,0|2,0,0]=4 1300 B13R1.14 CNC(=O)\C=C\c1ccc(C)cc1 Amb3709791 [1,1,0,0,0,0|1,0,0]=3 1301 B13R1.14 CNC(=O)\C=C\c1ccc(F)cc1 Amb3652110 [1,1,0,0,0,0|1,0,0]=3 1302 B13R1.14 CNC(=O)\C=C\c1ccc(N)cc1 Amb19844255 [1,1,0,0,0,0|1,0,0]=3 1303 B13R1.14 CNC(=O)\C=C\c1ccc(O)cc1 Amb27602328 [1,1,0,0,0,0|1,0,0]=3 1304 B13R1.14 COC(=O)C#Cc1ccc(Br)cc1 Amb2610346 [1,1,0,0,0,0|0,0,2]=4 1305 B13R1.14 COC(=O)C#Cc1ccc(C)cc1 Amb25897551 [1,1,0,0,0,0|0,0,2]=4 1306 B13R1.14 COC(=O)C#Cc1ccc(Cl)cc1 Amb2616309 [1,1,0,0,0,0|0,0,2]=4 1307 B13R1.14 COC(=O)C#Cc1ccc(F)cc1 Amb25726510 [1,1,0,0,0,0|0,0,2]=4 1308 B13R1.14 COC(=O)C#Cc1ccc(N)cc1 Amb25257395 [1,1,0,0,0,0|0,0,2]=4 1309 B13R1.14 COC(=O)C#Cc1ccc(O)cc1 Amb25262685 [1,1,0,0,0,0|0,0,2]=4 1310 B13R1.14 COC(=O)CCc1ccc(Br)cc1 Amb15692693 [1,1,0,0,0,0|0,0,2]=4 1311 B13R1.14 COC(=O)CCc1ccc(C)cc1 Amb17400662 [1,1,0,0,0,0|0,0,2]=4 1312 B13R1.14 COC(=O)CCc1ccc(Cl)cc1 Amb1093990 [1,1,0,0,0,0|0,0,2]=4 1313 B13R1.14 COC(=O)CCc1ccc(F)cc1 Amb17400909 [1,1,0,0,0,0|0,0,2]=4 1314 B13R1.14 COC(=O)CCc1ccc(I)cc1 Amb30640065 [1,1,0,0,0,0|0,0,2]=4 1315 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb33801551 [1,1,0,0,0,0|0,0,2]=4 1316 B13R1.14 COC(=O)CCc1ccc(N)cc1 Amb4317820 [1,1,0,0,0,0|0,0,2]=4 1317 B13R1.14 COC(=O)CCc1ccc(O)cc1 Amb3939191 [1,1,0,0,0,0|0,0,2]=4 1318 B13R1.14 COC(=O)CNc1ccc(Br)cc1 Amb1921801 [1,1,0,0,0,0|1,0,1]=4 1319 B13R1.14 COC(=O)CNc1ccc(C)cc1 Amb6714107 [1,1,0,0,0,0|1,0,1]=4 1320 B13R1.14 COC(=O)CNc1ccc(Cl)cc1 Amb6711990 [1,1,0,0,0,0|1,0,1]=4 1321 B13R1.14 COC(=O)CNc1ccc(F)cc1 Amb6712342 [1,1,0,0,0,0|1,0,1]=4 1322 B13R1.14 COC(=O)CNc1ccc(N)cc1 Amb7767916 [1,1,0,0,0,0|1,0,1]=4 1323 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604010 [1,1,0,0,0,0|1,0,1]=4 1324 B13R1.14 COC(=O)CNc1ccc(O)cc1 Amb10604138 [1,1,0,0,0,0|1,0,1]=4 1325 B13R1.14 COC(=O)COc1ccc(Br)cc1 Amb6361342 [1,1,0,0,0,0|1,0,1]=4 1326 B13R1.14 COC(=O)COc1ccc(C)cc1 Amb844177 [1,1,0,0,0,0|1,0,1]=4 1327 B13R1.14 COC(=O)COc1ccc(Cl)cc1 Amb7102572 [1,1,0,0,0,0|1,0,1]=4 1328 B13R1.14 COC(=O)COc1ccc(F)cc1 Amb7752952 [1,1,0,0,0,0|1,0,1]=4 1329 B13R1.14 COC(=O)COc1ccc(I)cc1 Amb1929651 [1,1,0,0,0,0|1,0,1]=4 1330 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb23385314 [1,1,0,0,0,0|1,0,1]=4 1331 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb6372983 [1,1,0,0,0,0|1,0,1]=4 1332 B13R1.14 COC(=O)COc1ccc(O)cc1 Amb10975204 [1,1,0,0,0,0|1,0,1]=4 1333 B13R1.14 COC(=O)CSc1ccc(Cl)cc1 Amb6383264 [1,1,0,0,0,0|1,0,1]=4 1334 B13R1.14 COC(=O)CSc1ccc(N)cc1 Amb8930379 [1,1,0,0,0,0|1,0,1]=4 1335 B13R1.14 COC(=O)CSc1ccc(O)cc1 Amb18321905 [1,1,0,0,0,0|1,0,1]=4 1336 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [1,1,0,0,0,0|1,0,1]=4 1337 B13R1.14 COC(=O)NCc1ccc(C)cc1 Amb17869525 [1,1,0,0,0,0|1,0,1]=4 1338 B13R1.14 COC(=O)NCc1ccc(Cl)cc1 Amb6498503 [1,1,0,0,0,0|1,0,1]=4 1339 B13R1.14 COC(=O)NCc1ccc(F)cc1 Amb17860018 [1,1,0,0,0,0|1,0,1]=4 1340 B13R1.14 COC(=O)NCc1ccc(N)cc1 Amb8390013 [1,1,0,0,0,0|1,0,1]=4 1341 B13R1.14 COC(=O)NNc1ccc(Br)cc1 Amb28047452 [1,1,0,0,0,0|2,0,0]=4 1342 B13R1.14 COC(=O)NNc1ccc(Cl)cc1 Amb27603308 [1,1,0,0,0,0|2,0,0]=4 1343 B13R1.14 COC(=O)NSc1ccc(N)cc1 Amb27209585 [1,1,0,0,0,0|2,0,0]=4 1344 B13R1.14 COC(=O)\C=C/c1ccc(Cl)cc1 Amb26857585 [1,1,0,0,0,0|0,0,0]=2 1345 B13R1.14 COC(=O)\C=C\c1ccc(Br)cc1 Amb13883656 [1,1,0,0,0,0|0,0,0]=2 1346 B13R1.14 COC(=O)\C=C\c1ccc(Br)cn1 Amb25368788 [1,1,0,0,0,0|1,0,0]=3 1347 B13R1.14 COC(=O)\C=C\c1ccc(Br)nc1 Amb27449840 [1,1,0,0,0,0|1,0,0]=3 1348 B13R1.14 COC(=O)\C=C\c1ccc(C)cc1 Amb17844465 [1,1,0,0,0,0|0,0,0]=2 1349 B13R1.14 COC(=O)\C=C\c1ccc(C)cn1 Amb25079372 [1,1,0,0,0,0|1,0,0]=3 1350 B13R1.14 COC(=O)\C=C\c1ccc(Cl)cc1 Amb33513295 [1,1,0,0,0,0|0,0,0]=2 1351 B13R1.14 COC(=O)\C=C\c1ccc(Cl)cn1 Amb25047046 [1,1,0,0,0,0|1,0,0]=3 1352 B13R1.14 COC(=O)\C=C\c1ccc(Cl)nc1 Amb2196616 [1,1,0,0,0,0|1,0,0]=3 1353 B13R1.14 COC(=O)\C=C\c1ccc(F)cc1 Amb33997710 [1,1,0,0,0,0|0,0,0]=2 1354 B13R1.14 COC(=O)\C=C\c1ccc(F)nc1 Amb32645870 [1,1,0,0,0,0|1,0,0]=3 1355 B13R1.14 COC(=O)\C=C\c1ccc(N)cc1 Amb2697308 [1,1,0,0,0,0|0,0,0]=2 1356 B13R1.14 COC(=O)\C=C\c1ccc(N)nc1 Amb24558350 [1,1,0,0,0,0|1,0,0]=3 1357 B13R1.14 COC(=O)\C=C\c1ccc(O)cc1 Amb845412 [1,1,0,0,0,0|0,0,0]=2 1358 B13R1.14 COC(=O)\C=C\c1ccc(O)nc1 Amb31156089 [1,1,0,0,0,0|1,0,0]=3 1359 B13R1.14 COC(=O)\C=C\c1ccc(S)cc1 Amb17616841 [1,1,0,0,0,0|0,0,0]=2 1360 B13R1.14 COC(=O)\C=C\c1cnc(N)nc1 Amb27863620 [1,1,0,0,0,0|2,0,0]=4 1361 B13R1.14 COC(=O)\N=C\c1ccc(F)cc1 Amb27843428 [1,1,0,0,0,0|1,0,0]=3 1362 B13R1.14 CSC(=O)\C=C\c1ccc(O)cc1 Amb26984781 [1,1,0,0,0,0|0,1,0]=3 1363 B13R1.14 Cc1ccc(\C=C\C(=O)CCl)cc1 Amb27144050 [1,1,0,0,0,0|1,0,0]=3 1364 B13R1.14 NCC(=O)\C=C\c1ccc(F)cc1 Amb33418855 [1,1,0,0,0,0|1,0,0]=3 1365 B13R1.14 NNC(=O)\C=C\c1ccc(F)cc1 Amb16207876 [1,1,0,0,0,0|2,0,0]=4 1366 B13R1.14 NNC(=O)\C=C\c1ccc(O)cc1 Amb2612877 [1,1,0,0,0,0|2,0,0]=4 1367 B13R1.14 O=C(\C=C\c1ccc(Cl)cc1)NO Amb8371006 [1,1,0,0,0,0|2,0,0]=4 1368 B13R1.14 O=C(\C=C\c1ccc(F)cc1)CCl Amb33262390 [1,1,0,0,0,0|1,0,0]=3 1369 B13R1.14 O=C(\C=C\c1ccc(F)cc1)NO Amb28045585 [1,1,0,0,0,0|2,0,0]=4 1370 B13R1.14 O=C(\C=C\c1ccc(O)cc1)NO Amb24722969 [1,1,0,0,0,0|2,0,0]=4 1371 B13R1.14 O=CC(=O)\C=C\c1ccc(Cl)cc1 Amb25212273 [1,1,0,0,0,0|1,0,1]=4 1372 B13R1.15 C=CC(=O)\C=C\c1cccc(Br)c1 Amb33503220 [1,1,0,0,0,0|0,0,2]=4 1373 B13R1.15 C=CC(=O)\C=C\c1cccc(C)c1 Amb33503234 [1,1,0,0,0,0|0,0,2]=4 1374 B13R1.15 C=CC(=O)\C=C\c1cccc(Cl)c1 Amb33503240 [1,1,0,0,0,0|0,0,2]=4 1375 B13R1.15 C=CC(=O)\C=C\c1cccc(F)c1 Amb33503227 [1,1,0,0,0,0|0,0,2]=4 1376 B13R1.15 CCC(=O)CCc1cccc(Br)c1 Amb8869666 [1,1,0,0,0,0|0,0,2]=4 1377 B13R1.15 CCC(=O)CCc1cccc(C)c1 Amb9031665 [1,1,0,0,0,0|0,0,2]=4 1378 B13R1.15 CCC(=O)CCc1cccc(Cl)c1 Amb9031683 [1,1,0,0,0,0|0,0,2]=4 1379 B13R1.15 CCC(=O)CSc1cccc(Br)c1 Amb32682988 [1,1,0,0,0,0|1,0,1]=4 1380 B13R1.15 CCC(=O)CSc1cccc(C)c1 Amb18330491 [1,1,0,0,0,0|1,0,1]=4 1381 B13R1.15 CCC(=O)CSc1cccc(Cl)c1 Amb32682967 [1,1,0,0,0,0|1,0,1]=4 1382 B13R1.15 CCC(=O)CSc1cccc(F)c1 Amb32682972 [1,1,0,0,0,0|1,0,1]=4 1383 B13R1.15 CCC(=O)NCc1cccc(Br)c1 Amb2085744 [1,1,0,0,0,0|1,0,1]=4 1384 B13R1.15 CCC(=O)NCc1cccc(Cl)c1 Amb2023613 [1,1,0,0,0,0|1,0,1]=4 1385 B13R1.15 CCC(=O)NCc1cccc(F)c1 Amb26369355 [1,1,0,0,0,0|1,0,1]=4 1386 B13R1.15 CCS(=O)\N=C\c1cccc(Br)c1 Amb35726561 [1,1,0,0,0,0|2,0,0]=4 1387 B13R1.15 CCS(=O)\N=C\c1cccc(C)c1 Amb35733837 [1,1,0,0,0,0|2,0,0]=4 1388 B13R1.15 CCS(=O)\N=C\c1cccc(Cl)c1 Amb35726594 [1,1,0,0,0,0|2,0,0]=4 1389 B13R1.15 CCS(=O)\N=C\c1cccc(F)c1 Amb35726880 [1,1,0,0,0,0|2,0,0]=4 1390 B13R1.15 CCS(=O)\N=C\c1cccc(I)c1 Amb35681724 [1,1,0,0,0,0|2,0,0]=4 1391 B13R1.15 CCS(=O)\N=C\c1cccc(O)c1 Amb35726881 [1,1,0,0,0,0|2,0,0]=4 1392 B13R1.15 CNC(=O)\C=C/c1cccc(F)c1 Amb27793059 [1,1,0,0,0,0|1,0,0]=3 1393 B13R1.15 CNC(=O)\C=C\c1cccc(N)c1 Amb17138777 [1,1,0,0,0,0|1,0,0]=3 1394 B13R1.15 CNC(=O)\C=C\c1cncc(C)c1 Amb27810299 [1,1,0,0,0,0|2,0,0]=4 1395 B13R1.15 COC(=O)C#Cc1cccc(Br)c1 Amb26367370 [1,1,0,0,0,0|0,0,2]=4 1396 B13R1.15 COC(=O)C#Cc1cccc(C)c1 Amb27169780 [1,1,0,0,0,0|0,0,2]=4 1397 B13R1.15 COC(=O)C#Cc1cccc(F)c1 Amb25726243 [1,1,0,0,0,0|0,0,2]=4 1398 B13R1.15 COC(=O)C#Cc1cccc(N)c1 Amb32989932 [1,1,0,0,0,0|0,0,2]=4 1399 B13R1.15 COC(=O)C#Cc1cccc(O)c1 Amb32989938 [1,1,0,0,0,0|0,0,2]=4 1400 B13R1.15 COC(=O)CCc1cccc(Br)c1 Amb17410710 [1,1,0,0,0,0|0,0,2]=4 1401 B13R1.15 COC(=O)CCc1cccc(C)c1 Amb17400661 [1,1,0,0,0,0|0,0,2]=4 1402 B13R1.15 COC(=O)CCc1cccc(Cl)c1 Amb17402276 [1,1,0,0,0,0|0,0,2]=4 1403 B13R1.15 COC(=O)CCc1cccc(F)c1 Amb30868064 [1,1,0,0,0,0|0,0,2]=4 1404 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb18648245 [1,1,0,0,0,0|0,0,2]=4 1405 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb33533668 [1,1,0,0,0,0|0,0,2]=4 1406 B13R1.15 COC(=O)CCc1cccc(O)c1 Amb2695338 [1,1,0,0,0,0|0,0,2]=4 1407 B13R1.15 COC(=O)CNc1cccc(Br)c1 Amb6712280 [1,1,0,0,0,0|1,0,1]=4 1408 B13R1.15 COC(=O)CNc1cccc(C)c1 Amb6706758 [1,1,0,0,0,0|1,0,1]=4 1409 B13R1.15 COC(=O)CNc1cccc(Cl)c1 Amb6711877 [1,1,0,0,0,0|1,0,1]=4 1410 B13R1.15 COC(=O)CNc1cccc(F)c1 Amb6711935 [1,1,0,0,0,0|1,0,1]=4 1411 B13R1.15 COC(=O)CNc1cccc(N)c1 Amb8825462 [1,1,0,0,0,0|1,0,1]=4 1412 B13R1.15 COC(=O)CNc1cccc(O)c1 Amb27202255 [1,1,0,0,0,0|1,0,1]=4 1413 B13R1.15 COC(=O)COc1cccc(Br)c1 Amb7752993 [1,1,0,0,0,0|1,0,1]=4 1414 B13R1.15 COC(=O)COc1cccc(I)c1 Amb8830748 [1,1,0,0,0,0|1,0,1]=4 1415 B13R1.15 COC(=O)COc1cccc(N)c1 Amb1117898 [1,1,0,0,0,0|1,0,1]=4 1416 B13R1.15 COC(=O)COc1cccc(N)c1 Amb6893075 [1,1,0,0,0,0|1,0,1]=4 1417 B13R1.15 COC(=O)CSc1cccc(Br)c1 Amb30588444 [1,1,0,0,0,0|1,0,1]=4 1418 B13R1.15 COC(=O)CSc1cccc(N)c1 Amb19005104 [1,1,0,0,0,0|1,0,1]=4 1419 B13R1.15 COC(=O)NCc1cccc(Br)c1 Amb2135033 [1,1,0,0,0,0|1,0,1]=4 1420 B13R1.15 COC(=O)NCc1cccc(C)c1 Amb25133958 [1,1,0,0,0,0|1,0,1]=4 1421 B13R1.15 COC(=O)NCc1cccc(Cl)c1 Amb2023614 [1,1,0,0,0,0|1,0,1]=4 1422 B13R1.15 COC(=O)NCc1cccc(O)c1 Amb18181287 [1,1,0,0,0,0|1,0,1]=4 1423 B13R1.15 COC(=O)NNc1cccc(C)c1 Amb26991502 [1,1,0,0,0,0|2,0,0]=4 1424 B13R1.15 COC(=O)\C=C\c1cc(Cl)ccn1 Amb33469155 [1,1,0,0,0,0|1,0,0]=3 1425 B13R1.15 COC(=O)\C=C\c1cccc(Br)c1 Amb2407728 [1,1,0,0,0,0|0,0,0]=2 1426 B13R1.15 COC(=O)\C=C\c1cccc(Br)n1 Amb20248559 [1,1,0,0,0,0|1,0,0]=3 1427 B13R1.15 COC(=O)\C=C\c1cccc(C)c1 Amb27474091 [1,1,0,0,0,0|0,0,0]=2 1428 B13R1.15 COC(=O)\C=C\c1cccc(C)n1 Amb28044037 [1,1,0,0,0,0|1,0,0]=3 1429 B13R1.15 COC(=O)\C=C\c1cccc(Cl)c1 Amb34003410 [1,1,0,0,0,0|0,0,0]=2 1430 B13R1.15 COC(=O)\C=C\c1cccc(F)c1 Amb10839543 [1,1,0,0,0,0|0,0,0]=2 1431 B13R1.15 COC(=O)\C=C\c1cccc(N)c1 Amb34006706 [1,1,0,0,0,0|0,0,0]=2 1432 B13R1.15 COC(=O)\C=C\c1cccc(N)n1 Amb26916102 [1,1,0,0,0,0|1,0,0]=3 1433 B13R1.15 COC(=O)\C=C\c1cccc(O)c1 Amb18128083 [1,1,0,0,0,0|0,0,0]=2 1434 B13R1.15 COC(=O)\C=C\c1ccnc(C)n1 Amb27799554 [1,1,0,0,0,0|2,0,0]=4 1435 B13R1.15 COC(=O)\C=C\c1ccnc(Cl)c1 Amb28400500 [1,1,0,0,0,0|1,0,0]=3 1436 B13R1.15 COC(=O)\C=C\c1cncc(Br)c1 Amb25880312 [1,1,0,0,0,0|1,0,0]=3 1437 B13R1.15 COC(=O)\C=C\c1cncc(F)c1 Amb27207570 [1,1,0,0,0,0|1,0,0]=3 1438 B13R1.15 COC(=O)\C=C\c1cncc(F)c1 Amb33715482 [1,1,0,0,0,0|1,0,0]=3 1439 B13R1.15 COC(=O)\C=C\c1cncc(O)c1 Amb27649898 [1,1,0,0,0,0|1,0,0]=3 1440 B13R1.15 NNC(=O)\C=C\c1cccc(Br)c1 Amb8998051 [1,1,0,0,0,0|2,0,0]=4 1441 B13R1.135 C=C(CBr)\C(C)=C\c1ccccc1 Amb33381248 [1,1,0,0,0,0|2,0,0]=4 1442 B13R1.135 C=C(CCl)\C(C)=C\c1ccccc1 Amb33381253 [1,1,0,0,0,0|2,0,0]=4 1443 B13R1.135 C=C(CN)\C(C)=C\c1ccccc1 Amb33380900 [1,1,0,0,0,0|2,0,0]=4 1444 B13R1.135 C=C(Cc1ccccc1)C(=O)OC Amb8390348 [1,1,0,0,0,0|0,0,1]=3 1445 B13R1.135 C=CC(=O)\C(C)=C\c1ccccc1 Amb33081532 [1,1,0,0,0,0|0,0,2]=4 1446 B13R1.135 CCC(=O)C(C)Cc1ccccc1 Amb17233202 [1,1,0,0,0,0|0,0,2]=4 1447 B13R1.135 CCC(=O)C(C)Sc1ccccc1 Amb32683032 [1,1,0,0,0,0|1,0,1]=4 1448 B13R1.135 CCC(=O)N(C)Cc1ccccc1 Amb3886753 [1,1,0,0,0,0|1,0,1]=4 1449 B13R1.135 CCC(=O)\C(C)=C\c1ccccc1 Amb27428384 [1,1,0,0,0,0|0,0,0]=2 1450 B13R1.135 CCC(=O)\C(C)=C\c1cccnc1 Amb24633428 [1,1,0,0,0,0|1,0,0]=3 1451 B13R1.135 CC[C@@H](O)\C(C)=C\c1ccccc1 Amb27852767 [1,1,0,0,0,0|0,0,2]=4 1452 B13R1.135 CC[C@@H](O)\C(Cl)=C\c1ccccc1 Amb27456661 [1,1,0,0,0,0|0,0,2]=4 1453 B13R1.135 CC[C@H](O)\C(C)=C\c1ccccc1 Amb28281705 [1,1,0,0,0,0|0,0,2]=4 1454 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [1,1,0,0,0,0|1,0,1]=4 1455 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [1,1,0,0,0,0|2,0,0]=4 1456 B13R1.135 CNC(=O)\C(C)=C\c1ccccc1 Amb3447584 [1,1,0,0,0,0|1,0,0]=3 1457 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [1,1,0,0,0,0|0,0,1]=3 1458 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [1,1,0,0,0,0|1,0,1]=4 1459 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [1,1,0,0,0,0|1,0,1]=4 1460 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [1,1,0,0,0,0|1,0,1]=4 1461 B13R1.135 COC(=O)C(=O)Nc1ccccn1 Amb2604638 [1,1,0,0,0,0|2,0,0]=4 1462 B13R1.135 COC(=O)C(=O)Nc1ccncc1 Amb27625625 [1,1,0,0,0,0|2,0,0]=4 1463 B13R1.135 COC(=O)C(Br)Cc1ccccc1 Amb9758191 [1,1,0,0,0,0|0,0,2]=4 1464 B13R1.135 COC(=O)C(C)Cc1ccccc1 Amb32412695 [1,1,0,0,0,0|0,0,2]=4 1465 B13R1.135 COC(=O)C(C)Nc1ccccc1 Amb4137936 [1,1,0,0,0,0|1,0,1]=4 1466 B13R1.135 COC(=O)C(C)Oc1ccccc1 Amb2780660 [1,1,0,0,0,0|1,0,1]=4 1467 B13R1.135 COC(=O)C(Cl)Cc1ccccc1 Amb17204377 [1,1,0,0,0,0|0,0,2]=4 1468 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb1779248 [1,1,0,0,0,0|0,0,2]=4 1469 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [1,1,0,0,0,0|0,0,2]=4 1470 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb6335185 [1,1,0,0,0,0|0,0,2]=4 1471 B13R1.135 COC(=O)C(O)Cc1ccccc1 Amb17138951 [1,1,0,0,0,0|0,0,2]=4 1472 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb533665 [1,1,0,0,0,0|0,0,2]=4 1473 B13R1.135 COC(=O)[C@@H](N)Cc1ccccc1 Amb6364970 [1,1,0,0,0,0|0,0,2]=4 1474 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 Amb5722454 [1,1,0,0,0,0|0,0,2]=4 1475 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb3939007 [1,1,0,0,0,0|0,0,2]=4 1476 B13R1.135 COC(=O)[C@H](N)Cc1ccccc1 Amb8396272 [1,1,0,0,0,0|0,0,2]=4 1477 B13R1.135 COC(=O)[C@H](O)Cc1ccccc1 Amb8390894 [1,1,0,0,0,0|0,0,2]=4 1478 B13R1.135 COC(=O)\C(Br)=C\c1ccccc1 Amb24331619 [1,1,0,0,0,0|0,0,0]=2 1479 B13R1.135 COC(=O)\C(C)=C\c1cncnc1 Amb27652628 [1,1,0,0,0,0|2,0,0]=4 1480 B13R1.135 C\C(=C/c1ccccc1)C(=O)CCl Amb27657602 [1,1,0,0,0,0|1,0,0]=3 1481 B13R1.135 C\C(=C/c1ccccc1)C(=O)CN Amb33476121 [1,1,0,0,0,0|1,0,0]=3 1482 B13R1.135 NNC(=O)\C(F)=C\c1ccccc1 Amb27833930 [1,1,0,0,0,0|2,0,0]=4 1483 B13R1.254 CNS(=O)(=O)\C=C\c1ccccc1 Amb404597 [1,1,0,0,0,0|2,0,0]=4 1484 B13R1.351 C=C(\C=C\c1ccccc1)C(C)=O Amb27205181 [1,1,0,0,0,0|1,0,1]=4 1485 B13R1.351 C=C(\C=C\c1ccccc1)C(C)O Amb28064123 [1,1,0,0,0,0|1,0,0]=3 1486 B13R1.351 CC(Br)C(=O)C#Cc1ccccc1 Amb27980682 [1,1,0,0,0,0|0,0,2]=4 1487 B13R1.351 CC(Br)C(=O)NCc1ccccc1 Amb837025 [1,1,0,0,0,0|1,0,1]=4 1488 B13R1.351 CC(C)C(=O)C#Cc1ccccc1 Amb5399008 [1,1,0,0,0,0|0,0,2]=4 1489 B13R1.351 CC(C)C(=O)CCc1ccccc1 Amb33552878 [1,1,0,0,0,0|0,0,2]=4 1490 B13R1.351 CC(C)C(=O)CSc1ccccc1 Amb32941888 [1,1,0,0,0,0|1,0,1]=4 1491 B13R1.351 CC(C)C(=O)NCc1ccccc1 Amb1806323 [1,1,0,0,0,0|1,0,1]=4 1492 B13R1.351 CC(C)C(=O)NNc1ccccc1 Amb5718331 [1,1,0,0,0,0|2,0,0]=4 1493 B13R1.351 CC(C)C(=O)\C=C\c1ccncc1 Amb25294423 [1,1,0,0,0,0|1,0,0]=3 1494 B13R1.351 CC(C)C(Cl)\C=C\c1ccccc1 Amb27419922 [1,1,0,0,0,0|1,0,1]=4 1495 B13R1.351 CC(C)C(O)\C=C\c1ccccc1 Amb27405123 [1,1,0,0,0,0|0,0,2]=4 1496 B13R1.351 CC(C)S(=O)\N=C\c1ccccc1 Amb35681776 [1,1,0,0,0,0|2,0,0]=4 1497 B13R1.351 CC(Cl)C(=O)CCc1ccccc1 Amb33496212 [1,1,0,0,0,0|0,0,2]=4 1498 B13R1.351 CC(Cl)C(=O)NCc1ccccc1 Amb9723883 [1,1,0,0,0,0|1,0,1]=4 1499 B13R1.351 CC(Cl)C(=O)OCc1ccccc1 Amb27592133 [1,1,0,0,0,0|1,0,1]=4 1500 B13R1.351 CC(N)C(=O)C#Cc1ccccc1 Amb27862794 [1,1,0,0,0,0|0,0,2]=4 1501 B13R1.351 CC(N)C(=O)CCc1ccccc1 Amb32953323 [1,1,0,0,0,0|0,0,2]=4 1502 B13R1.351 CC(N)C(=O)NCc1ccccc1 Amb10610119 [1,1,0,0,0,0|1,0,1]=4 1503 B13R1.351 CC(N)C(=O)NCc1ccccc1 Amb6258226 [1,1,0,0,0,0|1,0,1]=4 1504 B13R1.351 CC(N)C(=O)NNc1ccccc1 Amb28454817 [1,1,0,0,0,0|2,0,0]=4 1505 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb17335303 [1,1,0,0,0,0|1,0,1]=4 1506 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb22233549 [1,1,0,0,0,0|1,0,1]=4 1507 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb9825328 [1,1,0,0,0,0|1,0,1]=4 1508 B13R1.351 CC(N)C(=O)\C=C\c1ccccc1 Amb32953293 [1,1,0,0,0,0|0,0,0]=2 1509 B13R1.351 CC(O)C(=O)C#Cc1ccccc1 Amb27164720 [1,1,0,0,0,0|0,0,2]=4 1510 B13R1.351 CC(O)C(=O)NCc1ccccc1 Amb10766141 [1,1,0,0,0,0|1,0,1]=4 1511 B13R1.351 CC(O)C(=O)NNc1ccccc1 Amb27457677 [1,1,0,0,0,0|2,0,0]=4 1512 B13R1.351 CC(O)C(=O)OCc1ccccc1 Amb4021021 [1,1,0,0,0,0|1,0,1]=4 1513 B13R1.351 CC(O)C(C)\C=C\c1ccccc1 Amb32950466 [1,1,0,0,0,0|1,0,1]=4 1514 B13R1.351 CC(O)C(O)\C=C\c1ccccc1 Amb27206448 [1,1,0,0,0,0|0,0,2]=4 1515 B13R1.351 CC(S)C(=O)NCc1ccccc1 Amb27864076 [1,1,0,0,0,0|1,0,1]=4 1516 B13R1.351 CN(C)C(=O)\C=C\c1ccccc1 Amb2610528 [1,1,0,0,0,0|1,0,0]=3 1517 B13R1.351 CN(C)C(=O)\C=C\c1ccncc1 Amb27162427 [1,1,0,0,0,0|2,0,0]=4 1518 B13R1.351 C[C@@H](N)C(=O)C#Cc1ccccc1 Amb35738255 [1,1,0,0,0,0|0,0,2]=4 1519 B13R1.351 C[C@@H](N)C(=O)NCc1ccccc1 Amb18014651 [1,1,0,0,0,0|1,0,1]=4 1520 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb16183910 [1,1,0,0,0,0|1,0,1]=4 1521 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb2732392 [1,1,0,0,0,0|1,0,1]=4 1522 B13R1.351 C[C@@H](N)C(=O)OCc1ccccc1 Amb2732394 [1,1,0,0,0,0|1,0,1]=4 1523 B13R1.351 C[C@@H](N)[C@@H](O)\C=C\c1ccccc1 Amb25843898 [1,1,0,0,0,0|0,0,2]=4 1524 B13R1.351 C[C@@H](O)C(=O)OCc1ccccc1 Amb22801052 [1,1,0,0,0,0|1,0,1]=4 1525 B13R1.351 C[C@@H](O)[C@@H](N)\C=C\c1ccccc1 Amb27623283 [1,1,0,0,0,0|1,0,1]=4 1526 B13R1.351 C[C@@H](O)[C@H](C)\C=C\c1ccccc1 Amb28321539 [1,1,0,0,0,0|1,0,1]=4 1527 B13R1.351 C[C@H](N)C(=O)C#Cc1ccccc1 Amb30024790 [1,1,0,0,0,0|0,0,2]=4 1528 B13R1.351 C[C@H](N)C(=O)NCc1ccccc1 Amb5783207 [1,1,0,0,0,0|1,0,1]=4 1529 B13R1.351 C[C@H](N)C(=O)OCc1ccccc1 Amb2732393 [1,1,0,0,0,0|1,0,1]=4 1530 B13R1.351 C[C@H](N)C(=O)OCc1ccccc1 Amb8628594 [1,1,0,0,0,0|1,0,1]=4 1531 B13R1.351 C[C@H](N)[C@H](O)\C=C\c1ccccc1 Amb28367188 [1,1,0,0,0,0|0,0,2]=4 1532 B13R1.351 C[C@H](O)C(=O)OCc1ccccc1 Amb3939684 [1,1,0,0,0,0|1,0,1]=4 1533 B13R1.351 C[C@H](O)C(=O)\C=C\c1ccccc1 Amb27865928 [1,1,0,0,0,0|0,0,0]=2 1534 B13R1.351 C[C@H](O)[C@@H](C)\C=C\c1ccccc1 Amb28319963 [1,1,0,0,0,0|1,0,1]=4 1535 B13R1.351 C\C(=C/Sc1ccccc1)C(C)O Amb27653063 [1,1,0,0,0,0|2,0,0]=4 1536 B13R1.351 C\C(=C/Sc1ccccc1)[C@@H](C)O Amb27593921 [1,1,0,0,0,0|2,0,0]=4 1537 B13R1.351 O=C(O)C(=O)\C=C/c1ccccc1 Amb27628477 [1,1,0,0,0,0|1,0,1]=4 1538 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb16192457 [1,1,0,0,0,0|1,0,1]=4 1539 B13R1.351 O=C(O)C(=O)\C=C\c1ccccc1 Amb4477338 [1,1,0,0,0,0|1,0,1]=4 1540 B13R1.351 O=C(\C=C\c1ccccc1)C(F)F Amb33081940 [1,1,0,0,0,0|1,0,0]=3 1541 B13R1.417 CC\C(C=O)=C/Nc1ccccc1 Amb18127492 [1,1,0,0,0,0|1,0,0]=3 1542 B13R1.417 CN\C(=C\Cc1ccccc1)OC Amb27947297 [1,1,0,0,0,0|1,0,1]=4 1543 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [1,1,0,0,0,0|0,0,2]=4 1544 B13R1.417 COC(\C=C\c1ccccc1)=C\Cl Amb27601252 [1,1,0,0,0,0|1,0,0]=3 1545 B13R1.528 C=CC(=O)\C=C\c1ccccc1Br Amb33503232 [1,1,0,0,0,0|0,0,2]=4 1546 B13R1.528 C=CC(=O)\C=C\c1ccccc1C Amb33503233 [1,1,0,0,0,0|0,0,2]=4 1547 B13R1.528 C=CC(=O)\C=C\c1ccccc1Cl Amb33503120 [1,1,0,0,0,0|0,0,2]=4 1548 B13R1.528 C=CC(=O)\C=C\c1ccccc1F Amb33503119 [1,1,0,0,0,0|0,0,2]=4 1549 B13R1.528 CCC(=O)CCc1ccccc1C Amb9031664 [1,1,0,0,0,0|0,0,2]=4 1550 B13R1.528 CCC(=O)CCc1ccccc1Cl Amb9031682 [1,1,0,0,0,0|0,0,2]=4 1551 B13R1.528 CCC(=O)CCc1ccccc1F Amb9031685 [1,1,0,0,0,0|0,0,2]=4 1552 B13R1.528 CCC(=O)CSc1ccccc1Br Amb32682962 [1,1,0,0,0,0|1,0,1]=4 1553 B13R1.528 CCC(=O)CSc1ccccc1C Amb19080442 [1,1,0,0,0,0|1,0,1]=4 1554 B13R1.528 CCC(=O)CSc1ccccc1Cl Amb32682965 [1,1,0,0,0,0|1,0,1]=4 1555 B13R1.528 CCC(=O)CSc1ccccc1F Amb18331047 [1,1,0,0,0,0|1,0,1]=4 1556 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [1,1,0,0,0,0|1,0,1]=4 1557 B13R1.528 CCC(=O)NCc1ccccc1Cl Amb3094830 [1,1,0,0,0,0|1,0,1]=4 1558 B13R1.528 CCC(=O)NCc1ccccc1F Amb2020111 [1,1,0,0,0,0|1,0,1]=4 1559 B13R1.528 CCC(=O)NCc1ccccc1O Amb27173716 [1,1,0,0,0,0|1,0,1]=4 1560 B13R1.528 CCC(=O)NNc1ccccc1C Amb28398861 [1,1,0,0,0,0|2,0,0]=4 1561 B13R1.528 CCC(=O)NNc1ccccc1N Amb18128462 [1,1,0,0,0,0|2,0,0]=4 1562 B13R1.528 CCS(=O)\N=C\c1ccccc1Br Amb35685224 [1,1,0,0,0,0|2,0,0]=4 1563 B13R1.528 CCS(=O)\N=C\c1ccccc1C Amb35726858 [1,1,0,0,0,0|2,0,0]=4 1564 B13R1.528 CCS(=O)\N=C\c1ccccc1Cl Amb35726552 [1,1,0,0,0,0|2,0,0]=4 1565 B13R1.528 CCS(=O)\N=C\c1ccccc1F Amb35726879 [1,1,0,0,0,0|2,0,0]=4 1566 B13R1.528 CCS(=O)\N=C\c1ccccc1O Amb35726564 [1,1,0,0,0,0|2,0,0]=4 1567 B13R1.528 CNC(=O)\C=C\c1ccccc1Cl Amb3701970 [1,1,0,0,0,0|1,0,0]=3 1568 B13R1.528 CNC(=O)\C=C\c1ccccc1F Amb28249907 [1,1,0,0,0,0|1,0,0]=3 1569 B13R1.528 COC(=O)C#Cc1ccccc1C Amb26396263 [1,1,0,0,0,0|0,0,2]=4 1570 B13R1.528 COC(=O)C#Cc1ccccc1Cl Amb2610345 [1,1,0,0,0,0|0,0,2]=4 1571 B13R1.528 COC(=O)C#Cc1ccccc1F Amb28120540 [1,1,0,0,0,0|0,0,2]=4 1572 B13R1.528 COC(=O)C#Cc1ccccc1N Amb27179206 [1,1,0,0,0,0|0,0,2]=4 1573 B13R1.528 COC(=O)C#Cc1ccccc1O Amb27859426 [1,1,0,0,0,0|0,0,2]=4 1574 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [1,1,0,0,0,0|0,0,2]=4 1575 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [1,1,0,0,0,0|0,0,2]=4 1576 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [1,1,0,0,0,0|0,0,2]=4 1577 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [1,1,0,0,0,0|0,0,2]=4 1578 B13R1.528 COC(=O)CCc1ccccc1N Amb33803798 [1,1,0,0,0,0|0,0,2]=4 1579 B13R1.528 COC(=O)CCc1ccccc1O Amb2722678 [1,1,0,0,0,0|0,0,2]=4 1580 B13R1.528 COC(=O)CNc1ccccc1C Amb33527060 [1,1,0,0,0,0|1,0,1]=4 1581 B13R1.528 COC(=O)CNc1ccccc1Cl Amb6712398 [1,1,0,0,0,0|1,0,1]=4 1582 B13R1.528 COC(=O)CNc1ccccc1F Amb6712588 [1,1,0,0,0,0|1,0,1]=4 1583 B13R1.528 COC(=O)CNc1ccccc1N Amb7767918 [1,1,0,0,0,0|1,0,1]=4 1584 B13R1.528 COC(=O)COc1ccccc1Br Amb844184 [1,1,0,0,0,0|1,0,1]=4 1585 B13R1.528 COC(=O)COc1ccccc1C Amb844175 [1,1,0,0,0,0|1,0,1]=4 1586 B13R1.528 COC(=O)COc1ccccc1Cl Amb844182 [1,1,0,0,0,0|1,0,1]=4 1587 B13R1.528 COC(=O)COc1ccccc1F Amb7753081 [1,1,0,0,0,0|1,0,1]=4 1588 B13R1.528 COC(=O)CSc1ccccc1O Amb19044958 [1,1,0,0,0,0|1,0,1]=4 1589 B13R1.528 COC(=O)NCc1ccccc1C Amb27854441 [1,1,0,0,0,0|1,0,1]=4 1590 B13R1.528 COC(=O)NCc1ccccc1Cl Amb22469956 [1,1,0,0,0,0|1,0,1]=4 1591 B13R1.528 COC(=O)NCc1ccccc1O Amb8390014 [1,1,0,0,0,0|1,0,1]=4 1592 B13R1.528 COC(=O)\C=C\c1ccccc1Br Amb34002036 [1,1,0,0,0,0|0,0,0]=2 1593 B13R1.528 COC(=O)\C=C\c1ccccc1C Amb26325862 [1,1,0,0,0,0|0,0,0]=2 1594 B13R1.528 COC(=O)\C=C\c1ccccc1Cl Amb10808396 [1,1,0,0,0,0|0,0,0]=2 1595 B13R1.528 COC(=O)\C=C\c1ccccc1F Amb2432760 [1,1,0,0,0,0|0,0,0]=2 1596 B13R1.528 COC(=O)\C=C\c1ccccc1N Amb18127873 [1,1,0,0,0,0|0,0,0]=2 1597 B13R1.528 COC(=O)\C=C\c1cccnc1Br Amb22584147 [1,1,0,0,0,0|1,0,0]=3 1598 B13R1.528 COC(=O)\C=C\c1cccnc1N Amb4560893 [1,1,0,0,0,0|1,0,0]=3 1599 B13R1.528 COC(=O)\C=C\c1ccncc1F Amb24623916 [1,1,0,0,0,0|1,0,0]=3 1600 B13R1.528 COC(=O)\C=C\c1cnccc1Cl Amb13890041 [1,1,0,0,0,0|1,0,0]=3 1601 B13R1.528 COC(=O)\C=C\c1cnccc1N Amb4560910 [1,1,0,0,0,0|1,0,0]=3 1602 B13R1.528 COC(=O)\C=C\c1ncccc1C Amb28185662 [1,1,0,0,0,0|1,0,0]=3 1603 B13R1.528 COC(=O)\C=C\c1ncccc1F Amb33469154 [1,1,0,0,0,0|1,0,0]=3 1604 B13R1.528 COC(=O)\C=C\c1nccnc1C Amb35600947 [1,1,0,0,0,0|2,0,0]=4 1605 B13R1.528 COC(O)\C=C\c1ccccc1S Amb27206105 [1,1,0,0,0,0|0,0,2]=4 1606 B13R1.528 NNC(=O)\C=C\c1ccccc1Br Amb8998118 [1,1,0,0,0,0|2,0,0]=4 1607 B13R1.528 O=C(\C=C\c1ccccc1Cl)NO Amb28369653 [1,1,0,0,0,0|2,0,0]=4 1608 B13R1.19 CCCC(=O)Cc1ccc(C)cc1 Amb17138797 [0,1,0,0,1,0|1,0,1]=4 1609 B13R1.19 CCCC(=O)Cc1ccc(Cl)cc1 Amb17139628 [0,1,0,0,1,0|1,0,1]=4 1610 B13R1.19 CCCC(=O)Cc1ccc(F)cc1 Amb17138963 [0,1,0,0,1,0|1,0,1]=4 1611 B13R1.19 CCCC(=O)Nc1ccc(Br)cc1 Amb1195957 [0,1,0,0,1,0|2,0,0]=4 1612 B13R1.19 CCCC(=O)Nc1ccc(I)cc1 Amb2660684 [0,1,0,0,1,0|2,0,0]=4 1613 B13R1.19 CCCC(=O)Nc1ccc(N)cc1 Amb1790767 [0,1,0,0,1,0|2,0,0]=4 1614 B13R1.19 CCCC(=O)Nc1ccc(O)cc1 Amb2661517 [0,1,0,0,1,0|2,0,0]=4 1615 B13R1.19 CCCC(=O)Oc1ccc(Cl)cc1 Amb2674860 [0,1,0,0,1,0|2,0,0]=4 1616 B13R1.19 CCNC(=O)Cc1ccc(Br)cc1 Amb6393565 [0,1,0,0,1,0|1,0,1]=4 1617 B13R1.19 CCNC(=O)Cc1ccc(F)cc1 Amb3886791 [0,1,0,0,1,0|1,0,1]=4 1618 B13R1.19 CCNC(=O)Cc1ccc(N)cc1 Amb1112064 [0,1,0,0,1,0|1,0,1]=4 1619 B13R1.19 CCNC(=O)Cc1ccc(O)cc1 Amb26506351 [0,1,0,0,1,0|1,0,1]=4 1620 B13R1.19 CCNC(=O)Nc1ccc(Br)cc1 Amb3987206 [0,1,0,0,1,0|2,0,0]=4 1621 B13R1.19 CCNC(=O)Nc1ccc(Cl)cc1 Amb1233667 [0,1,0,0,1,0|2,0,0]=4 1622 B13R1.19 CCNC(=O)Nc1ccc(F)cc1 Amb8343741 [0,1,0,0,1,0|2,0,0]=4 1623 B13R1.19 CCNC(=O)Nc1ccc(I)cc1 Amb27757790 [0,1,0,0,1,0|2,0,0]=4 1624 B13R1.19 CCNC(=O)Nc1ccc(N)cc1 Amb9214939 [0,1,0,0,1,0|2,0,0]=4 1625 B13R1.19 CCNC(=O)Oc1ccc(C)cc1 Amb22359936 [0,1,0,0,1,0|2,0,0]=4 1626 B13R1.19 CCNC(=O)Oc1ccc(Cl)cc1 Amb22466857 [0,1,0,0,1,0|2,0,0]=4 1627 B13R1.19 CCNC(=O)Oc1ccc(O)cc1 Amb27960352 [0,1,0,0,1,0|2,0,0]=4 1628 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb20673163 [0,1,0,0,1,0|1,0,1]=4 1629 B13R1.19 CCOC(=N)Cc1ccc(Br)cc1 Amb24089938 [0,1,0,0,1,0|1,0,1]=4 1630 B13R1.19 CCOC(=N)Cc1ccc(C)cc1 Amb20673135 [0,1,0,0,1,0|1,0,1]=4 1631 B13R1.19 CCOC(=N)Cc1ccc(Cl)cc1 Amb20673154 [0,1,0,0,1,0|1,0,1]=4 1632 B13R1.19 CCOC(=N)Cc1ccc(F)cc1 Amb20673149 [0,1,0,0,1,0|1,0,1]=4 1633 B13R1.19 CCOC(=O)Cc1ccc(Br)cc1 Amb6366082 [0,1,0,0,1,0|0,0,1]=3 1634 B13R1.19 CCOC(=O)Cc1ccc(Br)cn1 Amb21963596 [0,1,0,0,1,0|1,0,1]=4 1635 B13R1.19 CCOC(=O)Cc1ccc(C)cc1 Amb2782811 [0,1,0,0,1,0|0,0,1]=3 1636 B13R1.19 CCOC(=O)Cc1ccc(C)cn1 Amb30625639 [0,1,0,0,1,0|1,0,1]=4 1637 B13R1.19 CCOC(=O)Cc1ccc(C)nc1 Amb22899586 [0,1,0,0,1,0|1,0,1]=4 1638 B13R1.19 CCOC(=O)Cc1ccc(Cl)cc1 Amb6383282 [0,1,0,0,1,0|0,0,1]=3 1639 B13R1.19 CCOC(=O)Cc1ccc(Cl)cn1 Amb23402253 [0,1,0,0,1,0|1,0,1]=4 1640 B13R1.19 CCOC(=O)Cc1ccc(Cl)nc1 Amb19515857 [0,1,0,0,1,0|1,0,1]=4 1641 B13R1.19 CCOC(=O)Cc1ccc(F)cc1 Amb9242950 [0,1,0,0,1,0|0,0,1]=3 1642 B13R1.19 CCOC(=O)Cc1ccc(F)cn1 Amb30874102 [0,1,0,0,1,0|1,0,1]=4 1643 B13R1.19 CCOC(=O)Cc1ccc(I)cc1 Amb16230826 [0,1,0,0,1,0|0,0,1]=3 1644 B13R1.19 CCOC(=O)Cc1ccc(I)cn1 Amb24183400 [0,1,0,0,1,0|1,0,1]=4 1645 B13R1.19 CCOC(=O)Cc1ccc(N)cc1 Amb6335373 [0,1,0,0,1,0|0,0,1]=3 1646 B13R1.19 CCOC(=O)Cc1ccc(N)cn1 Amb22234417 [0,1,0,0,1,0|1,0,1]=4 1647 B13R1.19 CCOC(=O)Cc1ccc(N)nc1 Amb22899575 [0,1,0,0,1,0|1,0,1]=4 1648 B13R1.19 CCOC(=O)Cc1ccc(O)cc1 Amb2780417 [0,1,0,0,1,0|0,0,1]=3 1649 B13R1.19 CCOC(=O)Cc1ccc(O)cn1 Amb22405966 [0,1,0,0,1,0|1,0,1]=4 1650 B13R1.19 CCOC(=O)Nc1ccc(Br)cc1 Amb3101834 [0,1,0,0,1,0|1,0,0]=3 1651 B13R1.19 CCOC(=O)Nc1ccc(Br)cn1 Amb6316782 [0,1,0,0,1,0|2,0,0]=4 1652 B13R1.19 CCOC(=O)Nc1ccc(Br)nc1 Amb16982207 [0,1,0,0,1,0|2,0,0]=4 1653 B13R1.19 CCOC(=O)Nc1ccc(C)cc1 Amb2500803 [0,1,0,0,1,0|1,0,0]=3 1654 B13R1.19 CCOC(=O)Nc1ccc(Cl)cc1 Amb1625034 [0,1,0,0,1,0|1,0,0]=3 1655 B13R1.19 CCOC(=O)Nc1ccc(Cl)cn1 Amb8585280 [0,1,0,0,1,0|2,0,0]=4 1656 B13R1.19 CCOC(=O)Nc1ccc(Cl)nc1 Amb27755058 [0,1,0,0,1,0|2,0,0]=4 1657 B13R1.19 CCOC(=O)Nc1ccc(F)cc1 Amb1095971 [0,1,0,0,1,0|1,0,0]=3 1658 B13R1.19 CCOC(=O)Nc1ccc(I)cc1 Amb1538826 [0,1,0,0,1,0|1,0,0]=3 1659 B13R1.19 CCOC(=O)Nc1ccc(N)cc1 Amb6373960 [0,1,0,0,1,0|1,0,0]=3 1660 B13R1.19 CCOC(=O)Nc1ccc(N)nc1 Amb18999686 [0,1,0,0,1,0|2,0,0]=4 1661 B13R1.19 CCOC(=O)Nc1ccc(O)cc1 Amb6738852 [0,1,0,0,1,0|1,0,0]=3 1662 B13R1.19 CCOC(=S)Nc1ccc(C)cc1 Amb24308972 [0,1,0,0,1,0|1,1,0]=4 1663 B13R1.19 Cc1ccc(NC(=O)OCCl)cc1 Amb29885598 [0,1,0,0,1,0|2,0,0]=4 1664 B13R1.19 O=C(Nc1ccc(Br)cc1)OCCl Amb35628677 [0,1,0,0,1,0|2,0,0]=4 1665 B13R1.19 O=C(Nc1ccc(Cl)cc1)OCCl Amb29880260 [0,1,0,0,1,0|2,0,0]=4 1666 B13R1.19 O=C(Nc1ccc(F)cc1)OCCl Amb30033131 [0,1,0,0,1,0|2,0,0]=4 1667 B13R1.19 O=C(Nc1ccc(I)cc1)OCCl Amb35628889 [0,1,0,0,1,0|2,0,0]=4 1668 B13R1.19 O=C(Nc1ccc(O)cc1)OCCl Amb29885611 [0,1,0,0,1,0|2,0,0]=4 1669 B13R1.19 O=C(OCCl)Oc1ccc(Br)cc1 Amb2779791 [0,1,0,0,1,0|2,0,0]=4 1670 B13R1.19 O=C(OCCl)Oc1ccc(Cl)cc1 Amb2779793 [0,1,0,0,1,0|2,0,0]=4 1671 B13R1.20 CCCC(=O)Cc1cccc(C)c1 Amb17138796 [0,1,0,0,1,0|1,0,1]=4 1672 B13R1.20 CCCC(=O)Cc1cccc(Cl)c1 Amb17139627 [0,1,0,0,1,0|1,0,1]=4 1673 B13R1.20 CCCC(=O)Cc1cccc(F)c1 Amb17138962 [0,1,0,0,1,0|1,0,1]=4 1674 B13R1.20 CCCC(=O)Nc1cccc(C)c1 Amb2674380 [0,1,0,0,1,0|2,0,0]=4 1675 B13R1.20 CCCC(=O)Nc1cccc(Cl)c1 Amb2674425 [0,1,0,0,1,0|2,0,0]=4 1676 B13R1.20 CCCC(=O)Nc1cccc(F)c1 Amb2674891 [0,1,0,0,1,0|2,0,0]=4 1677 B13R1.20 CCCC(=O)Nc1cccc(N)c1 Amb1798141 [0,1,0,0,1,0|2,0,0]=4 1678 B13R1.20 CCCC(=O)Nc1cccc(N)c1 Amb33549216 [0,1,0,0,1,0|2,0,0]=4 1679 B13R1.20 CCCC(=O)Nc1cccc(O)c1 Amb844198 [0,1,0,0,1,0|2,0,0]=4 1680 B13R1.20 CCCC(=O)Oc1cccc(C)c1 Amb24063564 [0,1,0,0,1,0|2,0,0]=4 1681 B13R1.20 CCNC(=O)Cc1cccc(Cl)c1 Amb23086727 [0,1,0,0,1,0|1,0,1]=4 1682 B13R1.20 CCNC(=O)Cc1cccc(F)c1 Amb8050210 [0,1,0,0,1,0|1,0,1]=4 1683 B13R1.20 CCNC(=O)Cc1cccc(N)c1 Amb8426828 [0,1,0,0,1,0|1,0,1]=4 1684 B13R1.20 CCNC(=O)Cc1cccc(O)c1 Amb18178662 [0,1,0,0,1,0|1,0,1]=4 1685 B13R1.20 CCNC(=O)Nc1cccc(Br)c1 Amb4020258 [0,1,0,0,1,0|2,0,0]=4 1686 B13R1.20 CCNC(=O)Nc1cccc(C)c1 Amb1233666 [0,1,0,0,1,0|2,0,0]=4 1687 B13R1.20 CCNC(=O)Nc1cccc(I)c1 Amb28067354 [0,1,0,0,1,0|2,0,0]=4 1688 B13R1.20 CCNC(=O)Nc1cccc(N)c1 Amb6614767 [0,1,0,0,1,0|2,0,0]=4 1689 B13R1.20 CCNC(=O)Oc1cccc(C)c1 Amb24490235 [0,1,0,0,1,0|2,0,0]=4 1690 B13R1.20 CCNC(=O)Oc1cccc(O)c1 Amb28722579 [0,1,0,0,1,0|2,0,0]=4 1691 B13R1.20 CCOC(=N)Cc1cccc(C)c1 Amb20673148 [0,1,0,0,1,0|1,0,1]=4 1692 B13R1.20 CCOC(=N)Cc1cccc(Cl)c1 Amb20673155 [0,1,0,0,1,0|1,0,1]=4 1693 B13R1.20 CCOC(=O)Cc1cc(Br)ccn1 Amb28990639 [0,1,0,0,1,0|1,0,1]=4 1694 B13R1.20 CCOC(=O)Cc1ccc[n+]([O-])c1 Amb10553693 [0,1,0,0,1,0|1,0,1]=4 1695 B13R1.20 CCOC(=O)Cc1cccc(Br)c1 Amb17349305 [0,1,0,0,1,0|0,0,1]=3 1696 B13R1.20 CCOC(=O)Cc1cccc(Br)n1 Amb22001965 [0,1,0,0,1,0|1,0,1]=4 1697 B13R1.20 CCOC(=O)Cc1cccc(C)c1 Amb6357154 [0,1,0,0,1,0|0,0,1]=3 1698 B13R1.20 CCOC(=O)Cc1cccc(C)n1 Amb15692898 [0,1,0,0,1,0|1,0,1]=4 1699 B13R1.20 CCOC(=O)Cc1cccc(C)n1 Amb24081752 [0,1,0,0,1,0|1,0,1]=4 1700 B13R1.20 CCOC(=O)Cc1cccc(Cl)c1 Amb8517419 [0,1,0,0,1,0|0,0,1]=3 1701 B13R1.20 CCOC(=O)Cc1cccc(Cl)n1 Amb22490590 [0,1,0,0,1,0|1,0,1]=4 1702 B13R1.20 CCOC(=O)Cc1cccc(F)c1 Amb9243013 [0,1,0,0,1,0|0,0,1]=3 1703 B13R1.20 CCOC(=O)Cc1cccc(I)c1 Amb23402106 [0,1,0,0,1,0|0,0,1]=3 1704 B13R1.20 CCOC(=O)Cc1cccc(N)c1 Amb32751199 [0,1,0,0,1,0|0,0,1]=3 1705 B13R1.20 CCOC(=O)Cc1cccc(N)c1 Amb8426813 [0,1,0,0,1,0|0,0,1]=3 1706 B13R1.20 CCOC(=O)Cc1cccc(N)n1 Amb8630464 [0,1,0,0,1,0|1,0,1]=4 1707 B13R1.20 CCOC(=O)Cc1cccc(O)c1 Amb17614082 [0,1,0,0,1,0|0,0,1]=3 1708 B13R1.20 CCOC(=O)Cc1ccnc(Br)c1 Amb33715609 [0,1,0,0,1,0|1,0,1]=4 1709 B13R1.20 CCOC(=O)Cc1ccnc(C)c1 Amb32668552 [0,1,0,0,1,0|1,0,1]=4 1710 B13R1.20 CCOC(=O)Cc1ccnc(C)c1 Amb32668853 [0,1,0,0,1,0|1,0,1]=4 1711 B13R1.20 CCOC(=O)Cc1ccnc(Cl)c1 Amb33291342 [0,1,0,0,1,0|1,0,1]=4 1712 B13R1.20 CCOC(=O)Cc1ccnc(F)c1 Amb32653587 [0,1,0,0,1,0|1,0,1]=4 1713 B13R1.20 CCOC(=O)Cc1ccnc(N)c1 Amb33736993 [0,1,0,0,1,0|1,0,1]=4 1714 B13R1.20 CCOC(=O)Cc1cncc(Br)c1 Amb21857707 [0,1,0,0,1,0|1,0,1]=4 1715 B13R1.20 CCOC(=O)Cc1cncc(F)c1 Amb19068169 [0,1,0,0,1,0|1,0,1]=4 1716 B13R1.20 CCOC(=O)Nc1cc(Br)ccn1 Amb27883427 [0,1,0,0,1,0|2,0,0]=4 1717 B13R1.20 CCOC(=O)Nc1cc(C)ccn1 Amb10553730 [0,1,0,0,1,0|2,0,0]=4 1718 B13R1.20 CCOC(=O)Nc1cc(Cl)ccn1 Amb27481561 [0,1,0,0,1,0|2,0,0]=4 1719 B13R1.20 CCOC(=O)Nc1cccc(C)c1 Amb3101819 [0,1,0,0,1,0|1,0,0]=3 1720 B13R1.20 CCOC(=O)Nc1cccc(C)n1 Amb10553731 [0,1,0,0,1,0|2,0,0]=4 1721 B13R1.20 CCOC(=O)Nc1cccc(Cl)c1 Amb3101832 [0,1,0,0,1,0|1,0,0]=3 1722 B13R1.20 CCOC(=O)Nc1cccc(Cl)n1 Amb27976498 [0,1,0,0,1,0|2,0,0]=4 1723 B13R1.20 CCOC(=O)Nc1cccc(F)n1 Amb24330398 [0,1,0,0,1,0|2,0,0]=4 1724 B13R1.20 CCOC(=O)Nc1cccc(N)c1 Amb13949212 [0,1,0,0,1,0|1,0,0]=3 1725 B13R1.20 CCOC(=O)Nc1cccc(N)c1 Amb6370312 [0,1,0,0,1,0|1,0,0]=3 1726 B13R1.20 CCOC(=O)Nc1cccc(O)c1 Amb379739 [0,1,0,0,1,0|1,0,0]=3 1727 B13R1.20 CCOC(=O)Nc1ccnc(Cl)c1 Amb22462755 [0,1,0,0,1,0|2,0,0]=4 1728 B13R1.20 CCOC(=O)Nc1cncc(Br)c1 Amb2752897 [0,1,0,0,1,0|2,0,0]=4 1729 B13R1.20 CCOC(=O)Nc1cncc(F)c1 Amb27233127 [0,1,0,0,1,0|2,0,0]=4 1730 B13R1.20 CCOC(=S)Nc1cccc(C)c1 Amb24308973 [0,1,0,0,1,0|1,1,0]=4 1731 B13R1.20 CCOC(=S)Nc1cccc(O)c1 Amb27587085 [0,1,0,0,1,0|1,1,0]=4 1732 B13R1.20 CCSC(=O)Nc1cccc(Cl)c1 Amb4414633 [0,1,0,0,1,0|1,1,0]=4 1733 B13R1.20 CCSC(=O)Nc1cccc(F)c1 Amb27794723 [0,1,0,0,1,0|1,1,0]=4 1734 B13R1.20 Cc1cccc(NC(=O)OCCl)c1 Amb29885599 [0,1,0,0,1,0|2,0,0]=4 1735 B13R1.20 O=C(Nc1cccc(Br)c1)OCCl Amb35628637 [0,1,0,0,1,0|2,0,0]=4 1736 B13R1.20 O=C(Nc1cccc(Cl)c1)OCCl Amb29880259 [0,1,0,0,1,0|2,0,0]=4 1737 B13R1.20 O=C(Nc1cccc(F)c1)OCCl Amb30033147 [0,1,0,0,1,0|2,0,0]=4 1738 B13R1.20 O=C(Nc1cccc(I)c1)OCCl Amb35628890 [0,1,0,0,1,0|2,0,0]=4 1739 B13R1.20 O=C(Nc1cccc(O)c1)OCCl Amb29885612 [0,1,0,0,1,0|2,0,0]=4 1740 B13R1.47 C=C(C(=O)OCC)c1ccccc1 Amb10602132 [0,1,0,0,1,0|0,0,0]=2 1741 B13R1.47 CCCC(=O)C(=O)c1ccccc1 Amb17594478 [0,1,0,0,1,0|1,0,0]=3 1742 B13R1.47 CCCC(=O)N(N)c1ccccc1 Amb24096809 [0,1,0,0,1,0|2,0,0]=4 1743 B13R1.47 CCNC(=O)C(=O)c1ccccc1 Amb17335165 [0,1,0,0,1,0|1,0,0]=3 1744 B13R1.47 CCNC(=O)C(Cl)c1ccccc1 Amb8825186 [0,1,0,0,1,0|1,0,1]=4 1745 B13R1.47 CCNC(=O)C(N)c1ccccc1 Amb6275596 [0,1,0,0,1,0|1,0,1]=4 1746 B13R1.47 CCNC(=O)C(O)c1ccccc1 Amb17400707 [0,1,0,0,1,0|1,0,1]=4 1747 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 Amb27790114 [0,1,0,0,1,0|1,0,1]=4 1748 B13R1.47 CCNC(=O)[C@@H](N)c1ccccc1 Amb17233443 [0,1,0,0,1,0|1,0,1]=4 1749 B13R1.47 CCOC(=O)C(=O)c1ccccc1 Amb1216483 [0,1,0,0,1,0|0,0,0]=2 1750 B13R1.47 CCOC(=O)C(=O)c1ccccn1 Amb6301483 [0,1,0,0,1,0|1,0,0]=3 1751 B13R1.47 CCOC(=O)C(=O)c1cccnc1 Amb19957923 [0,1,0,0,1,0|1,0,0]=3 1752 B13R1.47 CCOC(=O)C(Br)c1ccccc1 Amb5722344 [0,1,0,0,1,0|0,0,1]=3 1753 B13R1.47 CCOC(=O)C(Br)c1ccccn1 Amb24066454 [0,1,0,0,1,0|1,0,1]=4 1754 B13R1.47 CCOC(=O)C(Br)c1ccncc1 Amb24309216 [0,1,0,0,1,0|1,0,1]=4 1755 B13R1.47 CCOC(=O)C(C)c1ccccc1 Amb3429835 [0,1,0,0,1,0|0,0,1]=3 1756 B13R1.47 CCOC(=O)C(Cl)c1ccccc1 Amb1647396 [0,1,0,0,1,0|0,0,1]=3 1757 B13R1.47 CCOC(=O)C(N)c1ccccc1 Amb2756639 [0,1,0,0,1,0|0,0,1]=3 1758 B13R1.47 CCOC(=O)C(N)c1ccccc1 Amb7754483 [0,1,0,0,1,0|0,0,1]=3 1759 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb17935885 [0,1,0,0,1,0|1,0,1]=4 1760 B13R1.47 CCOC(=O)C(N)c1ccccn1 Amb3942220 [0,1,0,0,1,0|1,0,1]=4 1761 B13R1.47 CCOC(=O)C(N)c1cccnc1 Amb19003474 [0,1,0,0,1,0|1,0,1]=4 1762 B13R1.47 CCOC(=O)C(N)c1cccnc1 Amb31059483 [0,1,0,0,1,0|1,0,1]=4 1763 B13R1.47 CCOC(=O)C(O)c1ccccc1 Amb3939668 [0,1,0,0,1,0|0,0,1]=3 1764 B13R1.47 CCOC(=O)C(O)c1cccnc1 Amb18186776 [0,1,0,0,1,0|1,0,1]=4 1765 B13R1.47 CCOC(=O)C(O)c1cccnc1 Amb19351688 [0,1,0,0,1,0|1,0,1]=4 1766 B13R1.47 CCOC(=O)N(C)c1ccccc1 Amb4017512 [0,1,0,0,1,0|1,0,0]=3 1767 B13R1.47 CCOC(=O)N(C)c1ccccn1 Amb24095648 [0,1,0,0,1,0|2,0,0]=4 1768 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb10844947 [0,1,0,0,1,0|0,0,1]=3 1769 B13R1.47 CCOC(=O)[C@@H](N)c1ccccc1 Amb17678824 [0,1,0,0,1,0|0,0,1]=3 1770 B13R1.47 CCOC(=O)[C@@H](O)c1ccccc1 Amb3939685 [0,1,0,0,1,0|0,0,1]=3 1771 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb19889826 [0,1,0,0,1,0|0,0,1]=3 1772 B13R1.47 CCOC(=O)[C@H](N)c1ccccc1 Amb3940045 [0,1,0,0,1,0|0,0,1]=3 1773 B13R1.47 CCOC(=O)[C@H](O)c1ccccc1 Amb3939686 [0,1,0,0,1,0|0,0,1]=3 1774 B13R1.47 CC\C=C(\C)C(=O)c1ccccc1 Amb27252342 [0,1,0,0,1,0|2,0,0]=4 1775 B13R1.47 CC\C=C(\Cl)C(=O)c1ccccc1 Amb26442043 [0,1,0,0,1,0|2,0,0]=4 1776 B13R1.47 CC\C=C(\F)C(=O)c1ccccc1 Amb26420849 [0,1,0,0,1,0|2,0,0]=4 1777 B13R1.47 CONC(=O)C(=O)c1ccccc1 Amb27954049 [0,1,0,0,1,0|2,0,0]=4 1778 B13R1.79 CCO\C(C=O)=C/c1ccccc1 Amb22546895 [0,1,0,0,1,0|0,0,0]=2 1779 B13R1.348 CC(C)CC(=O)Cc1ccccc1 Amb15690932 [0,1,0,0,1,0|1,0,1]=4 1780 B13R1.348 CC(C)CC(=O)Nc1ccccc1 Amb3109675 [0,1,0,0,1,0|2,0,0]=4 1781 B13R1.348 CC(C)NC(=O)Cc1ccccc1 Amb3099551 [0,1,0,0,1,0|1,0,1]=4 1782 B13R1.348 CC(C)NC(=O)Nc1ccccc1 Amb3365184 [0,1,0,0,1,0|2,0,0]=4 1783 B13R1.348 CC(C)NC(=O)Oc1ccccc1 Amb2732288 [0,1,0,0,1,0|2,0,0]=4 1784 B13R1.348 CC(C)NC(=O)Sc1ccccc1 Amb27643652 [0,1,0,0,1,0|2,0,0]=4 1785 B13R1.348 CC(C)OC(=O)Cc1ccccc1 Amb6357769 [0,1,0,0,1,0|0,0,1]=3 1786 B13R1.348 CC(C)OC(=O)Nc1ccccc1 Amb6358017 [0,1,0,0,1,0|1,0,0]=3 1787 B13R1.348 CC(C)OC(=O)Nc1cccnc1 Amb24668962 [0,1,0,0,1,0|2,0,0]=4 1788 B13R1.348 CC(C)OC(=O)Nc1ccncc1 Amb4021843 [0,1,0,0,1,0|2,0,0]=4 1789 B13R1.348 CC(C)OC(=S)Nc1ccccc1 Amb1625289 [0,1,0,0,1,0|1,1,0]=4 1790 B13R1.348 CC(C)SC(=O)Nc1ccccc1 Amb4011071 [0,1,0,0,1,0|1,1,0]=4 1791 B13R1.348 CC(Cl)CC(=O)Nc1ccccc1 Amb17836214 [0,1,0,0,1,0|2,0,0]=4 1792 B13R1.348 CC(N)CC(=O)Nc1ccccc1 Amb18968728 [0,1,0,0,1,0|2,0,0]=4 1793 B13R1.348 CC(O)CC(=O)Nc1ccccc1 Amb2612921 [0,1,0,0,1,0|2,0,0]=4 1794 B13R1.348 CC(S)CC(=O)Nc1ccccc1 Amb32788690 [0,1,0,0,1,0|2,0,0]=4 1795 B13R1.348 C\C(=C/c1ccccc1)CC(C)Br Amb33476750 [0,1,0,0,1,0|2,0,0]=4 1796 B13R1.348 C\C(=C/c1ccccc1)CC(C)O Amb28190232 [0,1,0,0,1,0|2,0,0]=4 1797 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)N Amb33476743 [0,1,0,0,1,0|2,0,0]=4 1798 B13R1.348 C\C(=C/c1ccccc1)C[C@@H](C)O Amb32954504 [0,1,0,0,1,0|2,0,0]=4 1799 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)N Amb33476746 [0,1,0,0,1,0|2,0,0]=4 1800 B13R1.348 C\C(=C/c1ccccc1)C[C@H](C)O Amb32953325 [0,1,0,0,1,0|2,0,0]=4 1801 B13R1.470 CCCC(=O)Cc1ccccc1C Amb17138794 [0,1,0,0,1,0|1,0,1]=4 1802 B13R1.470 CCCC(=O)Cc1ccccc1Cl Amb17139625 [0,1,0,0,1,0|1,0,1]=4 1803 B13R1.470 CCCC(=O)Cc1ccccc1F Amb17138960 [0,1,0,0,1,0|1,0,1]=4 1804 B13R1.470 CCCC(=O)Nc1ccccc1Br Amb2587895 [0,1,0,0,1,0|2,0,0]=4 1805 B13R1.470 CCCC(=O)Nc1ccccc1Cl Amb2674431 [0,1,0,0,1,0|2,0,0]=4 1806 B13R1.470 CCCC(=O)Nc1ccccc1I Amb4133453 [0,1,0,0,1,0|2,0,0]=4 1807 B13R1.470 CCCC(=O)Nc1ccccc1N Amb33734468 [0,1,0,0,1,0|2,0,0]=4 1808 B13R1.470 CCCC(=O)Nc1ccccc1N Amb843224 [0,1,0,0,1,0|2,0,0]=4 1809 B13R1.470 CCCC(=O)Nc1ccccc1O Amb2660691 [0,1,0,0,1,0|2,0,0]=4 1810 B13R1.470 CCNC(=O)Cc1ccccc1Br Amb22230625 [0,1,0,0,1,0|1,0,1]=4 1811 B13R1.470 CCNC(=O)Cc1ccccc1Cl Amb23014083 [0,1,0,0,1,0|1,0,1]=4 1812 B13R1.470 CCNC(=O)Cc1ccccc1F Amb8341226 [0,1,0,0,1,0|1,0,1]=4 1813 B13R1.470 CCNC(=O)Cc1ccccc1N Amb1121104 [0,1,0,0,1,0|1,0,1]=4 1814 B13R1.470 CCNC(=O)Nc1ccccc1C Amb2236972 [0,1,0,0,1,0|2,0,0]=4 1815 B13R1.470 CCNC(=O)Nc1ccccc1Cl Amb4018016 [0,1,0,0,1,0|2,0,0]=4 1816 B13R1.470 CCNC(=O)Nc1ccccc1I Amb27414508 [0,1,0,0,1,0|2,0,0]=4 1817 B13R1.470 CCNC(=O)Oc1ccccc1C Amb24490439 [0,1,0,0,1,0|2,0,0]=4 1818 B13R1.470 CCNC(=O)Oc1ccccc1N Amb27476611 [0,1,0,0,1,0|2,0,0]=4 1819 B13R1.470 CCOC(=N)Cc1ccccc1C Amb20673147 [0,1,0,0,1,0|1,0,1]=4 1820 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb19083262 [0,1,0,0,1,0|1,0,1]=4 1821 B13R1.470 CCOC(=N)Cc1ccccc1Cl Amb20673156 [0,1,0,0,1,0|1,0,1]=4 1822 B13R1.470 CCOC(=N)Cc1ccccc1F Amb20673150 [0,1,0,0,1,0|1,0,1]=4 1823 B13R1.470 CCOC(=O)CN1C=CC=CC1=O Amb18186767 [0,1,0,0,1,0|1,0,1]=4 1824 B13R1.470 CCOC(=O)C[n+]1ccccc1C Amb2610041 [0,1,0,0,1,0|1,0,1]=4 1825 B13R1.470 CCOC(=O)Cc1ccccc1Br Amb3429172 [0,1,0,0,1,0|0,0,1]=3 1826 B13R1.470 CCOC(=O)Cc1ccccc1C Amb3940131 [0,1,0,0,1,0|0,0,1]=3 1827 B13R1.470 CCOC(=O)Cc1ccccc1Cl Amb9243016 [0,1,0,0,1,0|0,0,1]=3 1828 B13R1.470 CCOC(=O)Cc1ccccc1F Amb6357916 [0,1,0,0,1,0|0,0,1]=3 1829 B13R1.470 CCOC(=O)Cc1ccccc1I Amb22475916 [0,1,0,0,1,0|0,0,1]=3 1830 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2698942 [0,1,0,0,1,0|0,0,1]=3 1831 B13R1.470 CCOC(=O)Cc1ccccc1N Amb2699173 [0,1,0,0,1,0|0,0,1]=3 1832 B13R1.470 CCOC(=O)Cc1ccccc1O Amb17614081 [0,1,0,0,1,0|0,0,1]=3 1833 B13R1.470 CCOC(=O)Cc1cccnc1Cl Amb21960759 [0,1,0,0,1,0|1,0,1]=4 1834 B13R1.470 CCOC(=O)Cc1cccnc1N Amb32938644 [0,1,0,0,1,0|1,0,1]=4 1835 B13R1.470 CCOC(=O)Cc1ccncc1Br Amb21962528 [0,1,0,0,1,0|1,0,1]=4 1836 B13R1.470 CCOC(=O)Cc1ccncc1C Amb22739815 [0,1,0,0,1,0|1,0,1]=4 1837 B13R1.470 CCOC(=O)Cc1ccncc1Cl Amb26304162 [0,1,0,0,1,0|1,0,1]=4 1838 B13R1.470 CCOC(=O)Cc1ccncc1N Amb18128678 [0,1,0,0,1,0|1,0,1]=4 1839 B13R1.470 CCOC(=O)Cc1cnccc1Cl Amb33250358 [0,1,0,0,1,0|1,0,1]=4 1840 B13R1.470 CCOC(=O)Cc1ncccc1Br Amb21963898 [0,1,0,0,1,0|1,0,1]=4 1841 B13R1.470 CCOC(=O)Cc1ncccc1C Amb32882432 [0,1,0,0,1,0|1,0,1]=4 1842 B13R1.470 CCOC(=O)Cc1ncccc1I Amb22499041 [0,1,0,0,1,0|1,0,1]=4 1843 B13R1.470 CCOC(=O)Cc1ncccc1N Amb22295863 [0,1,0,0,1,0|1,0,1]=4 1844 B13R1.470 CCOC(=O)Cc1ncccc1O Amb18648470 [0,1,0,0,1,0|1,0,1]=4 1845 B13R1.470 CCOC(=O)Nc1ccccc1Br Amb6514657 [0,1,0,0,1,0|1,0,0]=3 1846 B13R1.470 CCOC(=O)Nc1ccccc1Cl Amb6514662 [0,1,0,0,1,0|1,0,0]=3 1847 B13R1.470 CCOC(=O)Nc1ccccc1I Amb27400466 [0,1,0,0,1,0|1,0,0]=3 1848 B13R1.470 CCOC(=O)Nc1cccnc1Cl Amb17792635 [0,1,0,0,1,0|2,0,0]=4 1849 B13R1.470 CCOC(=O)Nc1cccnc1F Amb30018373 [0,1,0,0,1,0|2,0,0]=4 1850 B13R1.470 CCOC(=O)Nc1cccnc1O Amb24490364 [0,1,0,0,1,0|2,0,0]=4 1851 B13R1.470 CCOC(=O)Nc1ccncc1Cl Amb27456271 [0,1,0,0,1,0|2,0,0]=4 1852 B13R1.470 CCOC(=O)Nc1ccncc1I Amb27757091 [0,1,0,0,1,0|2,0,0]=4 1853 B13R1.470 CCOC(=O)Nc1ccncc1N Amb19002524 [0,1,0,0,1,0|2,0,0]=4 1854 B13R1.470 CCOC(=O)Nc1cnccc1O Amb18129000 [0,1,0,0,1,0|2,0,0]=4 1855 B13R1.470 CCOC(=O)Nc1ncccc1C Amb3364657 [0,1,0,0,1,0|2,0,0]=4 1856 B13R1.470 CCOC(=O)Nc1ncccc1Cl Amb28204415 [0,1,0,0,1,0|2,0,0]=4 1857 B13R1.470 CCOC(=O)Nc1ncccc1I Amb28051098 [0,1,0,0,1,0|2,0,0]=4 1858 B13R1.470 CCOC(=O)Nc1ncccc1N Amb18128862 [0,1,0,0,1,0|2,0,0]=4 1859 B13R1.470 CCOC(=S)Nc1ccccc1C Amb27947437 [0,1,0,0,1,0|1,1,0]=4 1860 B13R1.470 CCOC(=S)Nc1ccccc1Cl Amb28133428 [0,1,0,0,1,0|1,1,0]=4 1861 B13R1.470 CCSC(=O)Nc1ccccc1C Amb27948118 [0,1,0,0,1,0|1,1,0]=4 1862 B13R1.470 Cc1ccccc1NC(=O)OCCl Amb29885600 [0,1,0,0,1,0|2,0,0]=4 1863 B13R1.470 O=C(Nc1ccccc1Br)OCCl Amb35628671 [0,1,0,0,1,0|2,0,0]=4 1864 B13R1.470 O=C(Nc1ccccc1Cl)OCCl Amb29880261 [0,1,0,0,1,0|2,0,0]=4 1865 B13R1.470 O=C(Nc1ccccc1F)OCCl Amb30033148 [0,1,0,0,1,0|2,0,0]=4 1866 B13R1.470 O=C(Nc1ccccc1I)OCCl Amb35628888 [0,1,0,0,1,0|2,0,0]=4 1867 B13R1.1327 CCOS(=O)(=O)Cc1ccccc1 Amb32668103 [0,1,0,0,1,0|1,0,1]=4 1868 B13R1.33 CCOC(=O)CC(=O)c1ccco1 Amb1945953 [0,1,0,0,1,0|1,0,1]=4 1869 B13R1.33 CCOC(=O)CC(=O)c1cccs1 Amb33529373 [0,1,0,0,1,0|1,0,1]=4 1870 B13R1.33 CCOC(=O)CC(=O)c1ccoc1 Amb8387832 [0,1,0,0,1,0|1,0,1]=4 1871 B13R1.33 CCOC(=O)CC(=O)c1ccsc1 Amb8387830 [0,1,0,0,1,0|1,0,1]=4 1872 B13R1.33 CCOC(=O)NC(=O)c1ccco1 Amb25192633 [0,1,0,0,1,0|2,0,0]=4 1873 B13R1.33 CCOC(=O)NC(=O)c1cccs1 Amb25054636 [0,1,0,0,1,0|2,0,0]=4 1874 B13R1.33 CCOC(=O)NC(=S)n1cccc1 Amb27402973 [0,1,0,0,1,0|2,0,0]=4 1875 B13R1.33 CCOC(=O)\C=C(\C)c1cccs1 Amb33493057 [0,1,0,0,1,0|1,0,0]=3 1876 B13R1.33 CCOC(=O)\C=C(\C)c1ccsc1 Amb33493143 [0,1,0,0,1,0|1,0,0]=3 1877 B13R1.33 CCOC(=O)\C=C(\C)c1cncs1 Amb33493236 [0,1,0,0,1,0|2,0,0]=4 1878 B13R1.33 CCOC(=O)\C=C(\C)c1cscn1 Amb33493248 [0,1,0,0,1,0|2,0,0]=4 1879 B13R1.33 CCOC(=O)\C=C(\C)c1ncco1 Amb33493253 [0,1,0,0,1,0|2,0,0]=4 1880 B13R1.33 CCOC(=O)\C=C(\C)c1nccs1 Amb33493178 [0,1,0,0,1,0|2,0,0]=4 1881 B13R1.41 CCNC(=O)\C=C\c1ccc(Cl)o1 Amb28051273 [0,1,0,0,1,0|2,0,0]=4 1882 B13R1.41 CCNC(=O)\C=C\c1ccc(Cl)s1 Amb27750493 [0,1,0,0,1,0|2,0,0]=4 1883 B13R1.41 CCNC(=O)\C=C\c1ccn(C)c1 Amb27211433 [0,1,0,0,1,0|2,0,0]=4 1884 B13R1.41 CCOC(=O)\C=C\c1cc(Br)cs1 Amb32412859 [0,1,0,0,1,0|1,0,0]=3 1885 B13R1.41 CCOC(=O)\C=C\c1cc(Br)cs1 Amb33715504 [0,1,0,0,1,0|1,0,0]=3 1886 B13R1.41 CCOC(=O)\C=C\c1ccc(Br)o1 Amb33469160 [0,1,0,0,1,0|1,0,0]=3 1887 B13R1.41 CCOC(=O)\C=C\c1ccc(C)o1 Amb33469157 [0,1,0,0,1,0|1,0,0]=3 1888 B13R1.41 CCOC(=O)\C=C\c1ccc(C)s1 Amb33469159 [0,1,0,0,1,0|1,0,0]=3 1889 B13R1.41 CCOC(=O)\C=C\c1ccc(Cl)o1 Amb33469161 [0,1,0,0,1,0|1,0,0]=3 1890 B13R1.41 CCOC(=O)\C=C\c1ccc(Cl)s1 Amb33469167 [0,1,0,0,1,0|1,0,0]=3 1891 B13R1.41 CCOC(=O)\C=C\c1cn(C)cn1 Amb33469187 [0,1,0,0,1,0|2,0,0]=4 1892 B13R1.41 CCOC(=O)\C=C\c1cnc(Cl)s1 Amb33469182 [0,1,0,0,1,0|2,0,0]=4 1893 B13R1.41 CCOC(=O)\C=C\c1cnn(C)c1 Amb30594528 [0,1,0,0,1,0|2,0,0]=4 1894 B13R1.41 CCOC(=O)\C=C\c1csc(Br)c1 Amb33469174 [0,1,0,0,1,0|1,0,0]=3 1895 B13R1.41 CCOC(=O)\C=C\c1csc(Br)n1 Amb33469193 [0,1,0,0,1,0|2,0,0]=4 1896 B13R1.41 CCOC(=O)\C=C\c1csc(C)n1 Amb33469164 [0,1,0,0,1,0|2,0,0]=4 1897 B13R1.153 O=C(\C=C\c1cccs1)NCCO Amb515894 [0,1,0,0,1,0|2,0,0]=4 1898 B13R1.444 CCOC(=O)\C=C\c1cccn1C Amb8389554 [0,1,0,0,1,0|1,0,0]=3 1899 B13R1.444 CCOC(=O)\C=C\c1ccnn1C Amb22372314 [0,1,0,0,1,0|2,0,0]=4 1900 B13R1.444 CCOC(=O)\C=C\c1ccoc1C Amb33469202 [0,1,0,0,1,0|1,0,0]=3 1901 B13R1.444 CCOC(=O)\C=C\c1cncn1C Amb32751315 [0,1,0,0,1,0|2,0,0]=4 1902 B13R1.444 CCOC(=O)\C=C\c1cscc1Br Amb33469183 [0,1,0,0,1,0|1,0,0]=3 1903 B13R1.444 CCOC(=O)\C=C\c1sccc1C Amb33469158 [0,1,0,0,1,0|1,0,0]=3 1904 B13R1.444 CCOC(=O)\C=C\c1scnc1C Amb33469200 [0,1,0,0,1,0|2,0,0]=4 1905 B13R1.593 CC(C)CC(=O)\C=C\c1ccco1 Amb17594541 [0,1,0,0,1,0|2,0,0]=4 1906 B13R1.593 CC(C)NC(=O)\C=C\c1ccco1 Amb6556587 [0,1,0,0,1,0|2,0,0]=4 1907 B13R1.593 CC(C)NC(=O)\C=C\c1cccs1 Amb898124 [0,1,0,0,1,0|2,0,0]=4 1908 B15R1.11 CCOC(=O)CCCc1ccc(Br)cc1 Amb18110225 [0,1,0,0,0,1|0,0,2]=4 1909 B15R1.11 CCOC(=O)CCCc1ccc(C)cc1 Amb18629310 [0,1,0,0,0,1|0,0,2]=4 1910 B15R1.11 CCOC(=O)CCCc1ccc(Cl)cc1 Amb18110226 [0,1,0,0,0,1|0,0,2]=4 1911 B15R1.11 CCOC(=O)CCCc1ccc(F)cc1 Amb18110227 [0,1,0,0,0,1|0,0,2]=4 1912 B15R1.11 CCOC(=O)CCCc1ccc(N)cc1 Amb20247754 [0,1,0,0,0,1|0,0,2]=4 1913 B15R1.11 CCOC(=O)CCCc1ccc(N)cc1 Amb34157974 [0,1,0,0,0,1|0,0,2]=4 1914 B15R1.11 CCOC(=O)CCCc1ccc(O)cc1 Amb22491838 [0,1,0,0,0,1|0,0,2]=4 1915 B15R1.11 CCOC(=O)CCNc1ccc(Br)cc1 Amb1981436 [0,1,0,0,0,1|0,0,2]=4 1916 B15R1.11 CCOC(=O)CCNc1ccc(C)cc1 Amb8867124 [0,1,0,0,0,1|0,0,2]=4 1917 B15R1.11 CCOC(=O)CCNc1ccc(Cl)cc1 Amb9026321 [0,1,0,0,0,1|0,0,2]=4 1918 B15R1.11 CCOC(=O)CCNc1ccc(F)cc1 Amb8867892 [0,1,0,0,0,1|0,0,2]=4 1919 B15R1.11 CCOC(=O)CCNc1ccc(N)cc1 Amb32418450 [0,1,0,0,0,1|0,0,2]=4 1920 B15R1.11 CCOC(=O)CCOc1ccc(I)cc1 Amb9026183 [0,1,0,0,0,1|0,0,2]=4 1921 B15R1.11 CCOC(=O)CCOc1ccc(N)cc1 Amb33803418 [0,1,0,0,0,1|0,0,2]=4 1922 B15R1.11 CCOC(=O)CCSc1ccc(C)cc1 Amb8390017 [0,1,0,0,0,1|0,0,2]=4 1923 B15R1.11 CCOC(=O)CCSc1ccc(F)cc1 Amb2725823 [0,1,0,0,0,1|0,0,2]=4 1924 B15R1.11 CCOC(=O)CNCc1ccc(Br)cc1 Amb17305755 [0,1,0,0,0,1|0,0,2]=4 1925 B15R1.11 CCOC(=O)CNCc1ccc(C)cc1 Amb13951238 [0,1,0,0,0,1|0,0,2]=4 1926 B15R1.11 CCOC(=O)CNCc1ccc(C)cc1 Amb6713722 [0,1,0,0,0,1|0,0,2]=4 1927 B15R1.11 CCOC(=O)CNCc1ccc(Cl)cc1 Amb6738129 [0,1,0,0,0,1|0,0,2]=4 1928 B15R1.11 CCOC(=O)CNCc1ccc(F)cc1 Amb33547867 [0,1,0,0,0,1|0,0,2]=4 1929 B15R1.11 CCOC(=O)CNCc1ccc(F)cc1 Amb6712528 [0,1,0,0,0,1|0,0,2]=4 1930 B15R1.11 CCOC(=O)CSCc1ccc(N)cc1 Amb9482685 [0,1,0,0,0,1|0,0,2]=4 1931 B15R1.11 CCOC(=O)NCCc1ccc(O)cc1 Amb2697961 [0,1,0,0,0,1|0,0,2]=4 1932 B15R1.11 CCOC(=O)\C=C\Cc1ccc(Cl)cc1 Amb22169827 [0,1,0,0,0,1|0,0,0]=2 1933 B15R1.11 CCOC(=O)\C=C\Nc1ccc(Br)cc1 Amb35676290 [0,1,0,0,0,1|0,0,0]=2 1934 B15R1.11 CCOC(=O)\C=C\Nc1ccc(C)cc1 Amb10559694 [0,1,0,0,0,1|0,0,0]=2 1935 B15R1.11 CCOC(=O)\C=C\Nc1ccc(Cl)cc1 Amb35676230 [0,1,0,0,0,1|0,0,0]=2 1936 B15R1.11 CCOC(=O)\C=C\Nc1ccc(F)cc1 Amb35709425 [0,1,0,0,0,1|0,0,0]=2 1937 B15R1.11 CCOC(=O)\C=C\Nc1ccc(I)cc1 Amb35675735 [0,1,0,0,0,1|0,0,0]=2 1938 B15R1.89 CCCC(=O)NNC(=O)c1ccccc1 Amb3097365 [0,1,0,0,0,1|2,0,0]=4 1939 B15R1.89 CCOC(=O)CCC(=O)c1ccccc1 Amb6305630 [0,1,0,0,0,1|0,0,1]=3 1940 B15R1.89 CCOC(=O)CCC(=O)c1ccccn1 Amb2699950 [0,1,0,0,0,1|1,0,1]=4 1941 B15R1.89 CCOC(=O)CCC(=O)c1cccnc1 Amb2699951 [0,1,0,0,0,1|1,0,1]=4 1942 B15R1.89 CCOC(=O)CCC(=O)c1ccncc1 Amb2699952 [0,1,0,0,0,1|1,0,1]=4 1943 B15R1.89 CCOC(=O)CCC(Br)c1ccccc1 Amb24089411 [0,1,0,0,0,1|0,0,2]=4 1944 B15R1.89 CCOC(=O)CCC(Cl)c1ccccc1 Amb17217298 [0,1,0,0,0,1|0,0,2]=4 1945 B15R1.89 CCOC(=O)CCC(O)c1ccccc1 Amb32666885 [0,1,0,0,0,1|0,0,2]=4 1946 B15R1.89 CCOC(=O)CNC(=O)c1ccccc1 Amb6356937 [0,1,0,0,0,1|0,0,1]=3 1947 B15R1.89 CCOC(=O)CNC(=O)c1cccnc1 Amb615151 [0,1,0,0,0,1|1,0,1]=4 1948 B15R1.89 CCOC(=O)CNC(=O)c1ccncc1 Amb3371697 [0,1,0,0,0,1|1,0,1]=4 1949 B15R1.89 CCOC(=O)CNC(C)c1ccccc1 Amb6706943 [0,1,0,0,0,1|0,0,2]=4 1950 B15R1.89 CCOC(=O)CN[C@@H](C)c1ccccc1 Amb17739848 [0,1,0,0,0,1|0,0,2]=4 1951 B15R1.89 CCOC(=O)CN[C@H](C)c1ccccc1 Amb17935772 [0,1,0,0,0,1|0,0,2]=4 1952 B15R1.89 CCOC(=O)O\N=C(/N)c1ccccc1 Amb22370859 [0,1,0,0,0,1|1,0,0]=3 1953 B15R1.89 CCOC(=O)O\N=C(/N)c1cccnc1 Amb10075141 [0,1,0,0,0,1|2,0,0]=4 1954 B15R1.89 CCOC(=O)\C=C\C(=O)c1ccccc1 Amb2435419 [0,1,0,0,0,1|0,0,0]=2 1955 B15R1.89 CCOC(=O)\C=N/[C@@H](C)c1ccccc1 Amb32405805 [0,1,0,0,0,1|0,0,1]=3 1956 B15R1.157 CCCOC(=O)CNCc1ccccc1 Amb28422434 [0,1,0,0,0,1|0,0,2]=4 1957 B15R1.157 CCOCC(=O)CCCc1ccccc1 Amb33129307 [0,1,0,0,0,1|0,0,2]=4 1958 B15R1.157 CCOCC(=O)CNCc1ccccc1 Amb33131586 [0,1,0,0,0,1|0,0,2]=4 1959 B15R1.157 CCONC(=O)CNCc1ccccc1 Amb27396626 [0,1,0,0,0,1|0,0,2]=4 1960 B15R1.633 CCOC(=O)CCCc1cccc(O)c1 Amb15692061 [0,1,0,0,0,1|0,0,2]=4 1961 B15R1.633 CCOC(=O)CCNc1cccc(Br)c1 Amb9026326 [0,1,0,0,0,1|0,0,2]=4 1962 B15R1.633 CCOC(=O)CCNc1cccc(O)c1 Amb18607736 [0,1,0,0,0,1|0,0,2]=4 1963 B15R1.633 CCOC(=O)CCSc1cccc(N)c1 Amb33803034 [0,1,0,0,0,1|0,0,2]=4 1964 B15R1.633 CCOC(=O)CNCc1cccc(C)c1 Amb17305756 [0,1,0,0,0,1|0,0,2]=4 1965 B15R1.633 CCOC(=O)CNCc1cccc(Cl)c1 Amb17305757 [0,1,0,0,0,1|0,0,2]=4 1966 B15R1.633 CCOC(=O)\C=C\Nc1cccc(Br)c1 Amb35676291 [0,1,0,0,0,1|0,0,0]=2 1967 B15R1.633 CCOC(=O)\C=C\Nc1cccc(C)c1 Amb29853758 [0,1,0,0,0,1|0,0,0]=2 1968 B15R1.633 CCOC(=O)\C=C\Nc1cccc(Cl)c1 Amb35676235 [0,1,0,0,0,1|0,0,0]=2 1969 B15R1.633 CCOC(=O)\C=C\Nc1cccc(F)c1 Amb29853759 [0,1,0,0,0,1|0,0,0]=2 1970 B15R1.633 CCOC(=O)\C=C\Nc1cccc(I)c1 Amb35675707 [0,1,0,0,0,1|0,0,0]=2 1971 B15R1.633 CCOC(=O)\C=C\Nc1cncc(Br)c1 Amb35676292 [0,1,0,0,0,1|1,0,0]=3 1972 B15R1.633 CCOC(=O)\C=C\Nc1cncc(Cl)c1 Amb35603365 [0,1,0,0,0,1|1,0,0]=3 1973 B15R1.633 CCOC(=O)\C=C\Oc1cccc(C)c1 Amb28465032 [0,1,0,0,0,1|0,0,0]=2 1974 B15R1.809 CCOC(=O)CC(=N)Oc1ccccc1 Amb20247941 [0,1,0,0,0,1|0,0,1]=3 1975 B15R1.809 CCOC(=O)CC(=O)Cc1ccccc1 Amb33539362 [0,1,0,0,0,1|0,0,1]=3 1976 B15R1.809 CCOC(=O)CC(=O)Nc1ccccc1 Amb2051237 [0,1,0,0,0,1|0,0,1]=3 1977 B15R1.809 CCOC(=O)CC(Br)Cc1ccccc1 Amb18111253 [0,1,0,0,0,1|0,0,2]=4 1978 B15R1.809 CCOC(=O)CC(Cl)Cc1ccccc1 Amb18111252 [0,1,0,0,0,1|0,0,2]=4 1979 B15R1.809 CCOC(=O)CC(N)Cc1ccccc1 Amb18110985 [0,1,0,0,0,1|0,0,2]=4 1980 B15R1.809 CCOC(=O)C[C@@H](N)Cc1ccccc1 Amb33039571 [0,1,0,0,0,1|0,0,2]=4 1981 B15R1.809 CCOC(=O)C[C@H](N)Cc1ccccc1 Amb33804747 [0,1,0,0,0,1|0,0,2]=4 1982 B15R1.809 CCOC(=O)NC(=S)Nc1ccccn1 Amb2409475 [0,1,0,0,0,1|2,0,0]=4 1983 B15R1.809 CCOC(=O)\C=C(/C)Nc1ccccc1 Amb4020002 [0,1,0,0,0,1|0,0,0]=2 1984 B15R1.809 CCOC(=O)\C=C(\C)Nc1ccccc1 Amb8503618 [0,1,0,0,0,1|0,0,0]=2 1985 B15R1.826 CCOC(=N)C(=O)OCc1ccccc1 Amb27169974 [0,1,0,0,0,1|1,0,1]=4 1986 B15R1.826 CCOC(=O)C(=O)CCc1ccccc1 Amb1233213 [0,1,0,0,0,1|0,0,1]=3 1987 B15R1.826 CCOC(=O)C(=O)CCc1cccnc1 Amb24066472 [0,1,0,0,0,1|1,0,1]=4 1988 B15R1.826 CCOC(=O)C(=O)NCc1ccccc1 Amb2221403 [0,1,0,0,0,1|0,0,1]=3 1989 B15R1.826 CCOC(=O)C(=O)NCc1ccccn1 Amb21953018 [0,1,0,0,0,1|1,0,1]=4 1990 B15R1.826 CCOC(=O)C(=O)NCc1ccncc1 Amb3887141 [0,1,0,0,0,1|1,0,1]=4 1991 B15R1.826 CCOC(=O)C(=O)\C=C\c1cccnc1 Amb33551995 [0,1,0,0,0,1|1,0,0]=3 1992 B15R1.826 CCOC(=O)C(C)NCc1ccccc1 Amb2724169 [0,1,0,0,0,1|0,0,2]=4 1993 B15R1.826 CCOC(=O)C(C)\N=C\c1ccccc1 Amb17609055 [0,1,0,0,0,1|0,0,1]=3 1994 B15R1.826 CCOC(=O)C(Cl)CCc1ccccc1 Amb20621212 [0,1,0,0,0,1|0,0,2]=4 1995 B15R1.826 CCOC(=O)C(F)OCc1ccccc1 Amb27242341 [0,1,0,0,0,1|0,0,2]=4 1996 B15R1.826 CCOC(=O)C(N)CCc1ccccc1 Amb3941426 [0,1,0,0,0,1|0,0,2]=4 1997 B15R1.826 CCOC(=O)C(O)CCc1ccccc1 Amb20621230 [0,1,0,0,0,1|0,0,2]=4 1998 B15R1.826 CCOC(=O)[C@@H](C)NCc1ccccc1 Amb27767100 [0,1,0,0,0,1|0,0,2]=4 1999 B15R1.826 CCOC(=O)[C@@H](C)OCc1ccccc1 Amb19132242 [0,1,0,0,0,1|0,0,2]=4 2000 B15R1.826 CCOC(=O)[C@@H](N)CCc1ccccc1 Amb2612895 [0,1,0,0,0,1|0,0,2]=4 2001 B15R1.826 CCOC(=O)[C@@H](N)CCc1ccccc1 Amb8393713 [0,1,0,0,0,1|0,0,2]=4 2002 B15R1.826 CCOC(=O)[C@@H](O)CCc1ccccc1 Amb8628957 [0,1,0,0,0,1|0,0,2]=4 2003 B15R1.826 CCOC(=O)[C@H](C)NCc1ccccc1 Amb25131194 [0,1,0,0,0,1|0,0,2]=4 2004 B15R1.826 CCOC(=O)[C@H](N)CCc1ccccc1 Amb15690587 [0,1,0,0,0,1|0,0,2]=4 2005 B15R1.826 CCOC(=O)[C@H](N)CCc1ccccc1 Amb33299912 [0,1,0,0,0,1|0,0,2]=4 2006 B15R1.826 CCOC(=O)[C@H](O)CCc1ccccc1 Amb3939673 [0,1,0,0,0,1|0,0,2]=4 2007 B15R1.826 CCOC(=O)\C(C)=N/Nc1ccccc1 Amb6487383 [0,1,0,0,0,1|1,0,0]=3 2008 B15R1.826 CCOC(=O)\C(Cl)=N/Nc1ccccc1 Amb1981002 [0,1,0,0,0,1|1,0,0]=3 2009 B15R1.826 CCOC(=O)\C(Cl)=N\Nc1ccccc1 Amb6366211 [0,1,0,0,0,1|1,0,0]=3 2010 B15R1.826 CCOC(=O)\C(N)=N/Nc1ccccc1 Amb19928994 [0,1,0,0,0,1|1,0,0]=3 2011 B15R1.1252 CCOC(=O)CCCc1ccccc1N Amb33802745 [0,1,0,0,0,1|0,0,2]=4 2012 B15R1.1252 CCOC(=O)CCCc1ccccc1O Amb15692062 [0,1,0,0,0,1|0,0,2]=4 2013 B15R1.1252 CCOC(=O)CCNc1ccccc1Br Amb9026324 [0,1,0,0,0,1|0,0,2]=4 2014 B15R1.1252 CCOC(=O)CCNc1ccccc1N Amb32418445 [0,1,0,0,0,1|0,0,2]=4 2015 B15R1.1252 CCOC(=O)CNCc1ccccc1O Amb32663765 [0,1,0,0,0,1|0,0,2]=4 2016 B15R1.1252 CCOC(=O)\C=C\Nc1ccccc1Br Amb35676289 [0,1,0,0,0,1|0,0,0]=2 2017 B15R1.1252 CCOC(=O)\C=C\Nc1ccccc1C Amb29853757 [0,1,0,0,0,1|0,0,0]=2 2018 B15R1.1252 CCOC(=O)\C=C\Nc1ccccc1Cl Amb35676220 [0,1,0,0,0,1|0,0,0]=2 2019 B15R1.1252 CCOC(=O)\C=C\Nc1ccccc1F Amb29853760 [0,1,0,0,0,1|0,0,0]=2 2020 B15R1.1252 CCOC(=O)\C=C\Nc1ccccc1I Amb35675648 [0,1,0,0,0,1|0,0,0]=2 2021 B15R1.9084 CC(C)OC(=O)CNCc1ccccc1 Amb27877790 [0,1,0,0,0,1|0,0,2]=4 2022 B15R1.9084 CC(C)OC(=O)NOCc1ccccc1 Amb28380915 [0,1,0,0,0,1|1,0,1]=4 2023 B15R1.23 CCCC(=O)CC(=O)c1ccc(Br)cc1 Amb33291169 [0,2,0,0,0,0|1,0,1]=4 2024 B15R1.23 CCCC(=O)CC(=O)c1ccc(C)cc1 Amb33291150 [0,2,0,0,0,0|1,0,1]=4 2025 B15R1.23 CCCC(=O)CC(=O)c1ccc(Cl)cc1 Amb33291163 [0,2,0,0,0,0|1,0,1]=4 2026 B15R1.23 CCCC(=O)CC(=O)c1ccc(F)cc1 Amb33291152 [0,2,0,0,0,0|1,0,1]=4 2027 B15R1.23 CCCC(=O)CC(=O)c1ccc(I)cc1 Amb33291170 [0,2,0,0,0,0|1,0,1]=4 2028 B15R1.23 CCOC(=O)CC(=O)c1ccc(Br)cc1 Amb2685445 [0,2,0,0,0,0|0,0,1]=3 2029 B15R1.23 CCOC(=O)CC(=O)c1ccc(Br)cn1 Amb32686907 [0,2,0,0,0,0|1,0,1]=4 2030 B15R1.23 CCOC(=O)CC(=O)c1ccc(Br)nc1 Amb2684105 [0,2,0,0,0,0|1,0,1]=4 2031 B15R1.23 CCOC(=O)CC(=O)c1ccc(C)cc1 Amb2689995 [0,2,0,0,0,0|0,0,1]=3 2032 B15R1.23 CCOC(=O)CC(=O)c1ccc(C)nc1 Amb30868036 [0,2,0,0,0,0|1,0,1]=4 2033 B15R1.23 CCOC(=O)CC(=O)c1ccc(Cl)cc1 Amb2686391 [0,2,0,0,0,0|0,0,1]=3 2034 B15R1.23 CCOC(=O)CC(=O)c1ccc(Cl)cn1 Amb33164174 [0,2,0,0,0,0|1,0,1]=4 2035 B15R1.23 CCOC(=O)CC(=O)c1ccc(Cl)nc1 Amb19944631 [0,2,0,0,0,0|1,0,1]=4 2036 B15R1.23 CCOC(=O)CC(=O)c1ccc(F)cc1 Amb2687855 [0,2,0,0,0,0|0,0,1]=3 2037 B15R1.23 CCOC(=O)CC(=O)c1ccc(F)cn1 Amb24117233 [0,2,0,0,0,0|1,0,1]=4 2038 B15R1.23 CCOC(=O)CC(=O)c1ccc(I)cc1 Amb10605281 [0,2,0,0,0,0|0,0,1]=3 2039 B15R1.23 CCOC(=O)CC(=O)c1ccc(N)cc1 Amb18655723 [0,2,0,0,0,0|0,0,1]=3 2040 B15R1.23 CCOC(=O)CC(=O)c1ccc(O)cc1 Amb10766326 [0,2,0,0,0,0|0,0,1]=3 2041 B15R1.23 CCOC(=O)CC(C)c1ccc(N)cc1 Amb33730105 [0,2,0,0,0,0|0,0,2]=4 2042 B15R1.23 CCOC(=O)CC(C)c1ccc(O)cc1 Amb32412822 [0,2,0,0,0,0|0,0,2]=4 2043 B15R1.23 CCOC(=O)CC(N)c1ccc(Br)cc1 Amb1840024 [0,2,0,0,0,0|0,0,2]=4 2044 B15R1.23 CCOC(=O)CC(N)c1ccc(Br)cc1 Amb33530112 [0,2,0,0,0,0|0,0,2]=4 2045 B15R1.23 CCOC(=O)CC(N)c1ccc(C)cc1 Amb1039536 [0,2,0,0,0,0|0,0,2]=4 2046 B15R1.23 CCOC(=O)CC(N)c1ccc(C)cc1 Amb33527150 [0,2,0,0,0,0|0,0,2]=4 2047 B15R1.23 CCOC(=O)CC(N)c1ccc(Cl)cc1 Amb1837276 [0,2,0,0,0,0|0,0,2]=4 2048 B15R1.23 CCOC(=O)CC(N)c1ccc(Cl)cc1 Amb2234508 [0,2,0,0,0,0|0,0,2]=4 2049 B15R1.23 CCOC(=O)CC(N)c1ccc(F)cc1 Amb1039653 [0,2,0,0,0,0|0,0,2]=4 2050 B15R1.23 CCOC(=O)CC(N)c1ccc(F)cc1 Amb2234504 [0,2,0,0,0,0|0,0,2]=4 2051 B15R1.23 CCOC(=O)CC(N)c1ccc(I)cc1 Amb1837431 [0,2,0,0,0,0|0,0,2]=4 2052 B15R1.23 CCOC(=O)CC(N)c1ccc(I)cc1 Amb2234526 [0,2,0,0,0,0|0,0,2]=4 2053 B15R1.23 CCOC(=O)CC(O)c1ccc(Br)cc1 Amb22059108 [0,2,0,0,0,0|0,0,2]=4 2054 B15R1.23 CCOC(=O)CC(O)c1ccc(O)cc1 Amb33530435 [0,2,0,0,0,0|0,0,2]=4 2055 B15R1.23 CCOC(=O)C[C@@H](N)c1ccc(Br)cc1 Amb19375541 [0,2,0,0,0,0|0,0,2]=4 2056 B15R1.23 CCOC(=O)C[C@H](N)c1ccc(Br)cc1 Amb19149286 [0,2,0,0,0,0|0,0,2]=4 2057 B15R1.23 CCOC(=O)C[C@H](N)c1ccc(Br)cc1 Amb33309134 [0,2,0,0,0,0|0,0,2]=4 2058 B15R1.23 CCOC(=O)\C=C(\C)c1ccc(Br)cc1 Amb33493039 [0,2,0,0,0,0|0,0,0]=2 2059 B15R1.23 CCOC(=O)\C=C(\C)c1ccc(C)cc1 Amb33493041 [0,2,0,0,0,0|0,0,0]=2 2060 B15R1.23 CCOC(=O)\C=C(\C)c1ccc(Cl)cc1 Amb33492952 [0,2,0,0,0,0|0,0,0]=2 2061 B15R1.23 CCOC(=O)\C=C(\C)c1ccc(F)cc1 Amb33493046 [0,2,0,0,0,0|0,0,0]=2 2062 B15R1.23 CCOC(=O)\C=C(\C)c1ccc(N)cc1 Amb33493035 [0,2,0,0,0,0|0,0,0]=2 2063 B15R1.24 CCCC(=O)CC(=O)c1cccc(Br)c1 Amb33291168 [0,2,0,0,0,0|1,0,1]=4 2064 B15R1.24 CCCC(=O)CC(=O)c1cccc(C)c1 Amb33291147 [0,2,0,0,0,0|1,0,1]=4 2065 B15R1.24 CCCC(=O)CC(=O)c1cccc(Cl)c1 Amb33291164 [0,2,0,0,0,0|1,0,1]=4 2066 B15R1.24 CCCC(=O)CC(=O)c1cccc(F)c1 Amb33291120 [0,2,0,0,0,0|1,0,1]=4 2067 B15R1.24 CCOC(=O)CC(=O)c1cccc(Br)c1 Amb2685444 [0,2,0,0,0,0|0,0,1]=3 2068 B15R1.24 CCOC(=O)CC(=O)c1cccc(Br)n1 Amb2684107 [0,2,0,0,0,0|1,0,1]=4 2069 B15R1.24 CCOC(=O)CC(=O)c1cccc(C)c1 Amb2689994 [0,2,0,0,0,0|0,0,1]=3 2070 B15R1.24 CCOC(=O)CC(=O)c1cccc(C)n1 Amb32412808 [0,2,0,0,0,0|1,0,1]=4 2071 B15R1.24 CCOC(=O)CC(=O)c1cccc(Cl)c1 Amb33529369 [0,2,0,0,0,0|0,0,1]=3 2072 B15R1.24 CCOC(=O)CC(=O)c1cccc(F)c1 Amb2688374 [0,2,0,0,0,0|0,0,1]=3 2073 B15R1.24 CCOC(=O)CC(=O)c1cccc(I)c1 Amb2688875 [0,2,0,0,0,0|0,0,1]=3 2074 B15R1.24 CCOC(=O)CC(=O)c1cccc(N)c1 Amb17529761 [0,2,0,0,0,0|0,0,1]=3 2075 B15R1.24 CCOC(=O)CC(=O)c1cccc(O)c1 Amb18656001 [0,2,0,0,0,0|0,0,1]=3 2076 B15R1.24 CCOC(=O)CC(=O)c1cncc(Br)c1 Amb2684106 [0,2,0,0,0,0|1,0,1]=4 2077 B15R1.24 CCOC(=O)CC(=O)c1cncc(F)c1 Amb33355350 [0,2,0,0,0,0|1,0,1]=4 2078 B15R1.24 CCOC(=O)CC(N)c1cccc(Br)c1 Amb2234505 [0,2,0,0,0,0|0,0,2]=4 2079 B15R1.24 CCOC(=O)CC(N)c1cccc(Br)c1 Amb31288600 [0,2,0,0,0,0|0,0,2]=4 2080 B15R1.24 CCOC(=O)CC(N)c1cccc(Br)c1 Amb33532041 [0,2,0,0,0,0|0,0,2]=4 2081 B15R1.24 CCOC(=O)CC(N)c1cccc(C)c1 Amb1842111 [0,2,0,0,0,0|0,0,2]=4 2082 B15R1.24 CCOC(=O)CC(N)c1cccc(C)c1 Amb2234519 [0,2,0,0,0,0|0,0,2]=4 2083 B15R1.24 CCOC(=O)CC(N)c1cccc(Cl)c1 Amb2234542 [0,2,0,0,0,0|0,0,2]=4 2084 B15R1.24 CCOC(=O)CC(N)c1cccc(Cl)c1 Amb33532044 [0,2,0,0,0,0|0,0,2]=4 2085 B15R1.24 CCOC(=O)CC(N)c1cccc(F)c1 Amb1839325 [0,2,0,0,0,0|0,0,2]=4 2086 B15R1.24 CCOC(=O)CC(N)c1cccc(O)c1 Amb1080936 [0,2,0,0,0,0|0,0,2]=4 2087 B15R1.24 CCOC(=O)CC(N)c1cccc(O)c1 Amb2234509 [0,2,0,0,0,0|0,0,2]=4 2088 B15R1.24 CCOC(=O)CC(O)c1cccc(Br)c1 Amb19374229 [0,2,0,0,0,0|0,0,2]=4 2089 B15R1.24 CCOC(=O)C[C@@H](N)c1cccc(I)c1 Amb33803340 [0,2,0,0,0,0|0,0,2]=4 2090 B15R1.24 CCOC(=O)\C=C(\C)c1cccc(Br)c1 Amb33493040 [0,2,0,0,0,0|0,0,0]=2 2091 B15R1.24 CCOC(=O)\C=C(\C)c1cccc(C)c1 Amb33493105 [0,2,0,0,0,0|0,0,0]=2 2092 B15R1.24 CCOC(=O)\C=C(\C)c1cccc(Cl)c1 Amb33493079 [0,2,0,0,0,0|0,0,0]=2 2093 B15R1.24 CCOC(=O)\C=C(\C)c1cccc(F)c1 Amb33493050 [0,2,0,0,0,0|0,0,0]=2 2094 B15R1.24 CCOC(=O)\C=C(\C)c1cccc(N)c1 Amb33493064 [0,2,0,0,0,0|0,0,0]=2 2095 B15R1.24 CCOC(=O)\C=C(\C)c1ccnc(F)c1 Amb33493256 [0,2,0,0,0,0|1,0,0]=3 2096 B15R1.24 CCOC(=O)\C=C(\C)c1cncc(Br)c1 Amb33493168 [0,2,0,0,0,0|1,0,0]=3 2097 B15R1.115 COCCC(=O)CC(=O)c1ccccc1 Amb8832993 [0,2,0,0,0,0|1,0,1]=4 2098 B15R1.115 O=C(CCCO)CC(=O)c1ccccc1 Amb3593281 [0,2,0,0,0,0|1,0,1]=4 2099 B15R1.578 CCOC(=O)C(=O)N(C)c1ccccc1 Amb3887122 [0,2,0,0,0,0|1,0,0]=3 2100 B15R1.578 CCOC(=O)C(Br)C(=O)c1ccccc1 Amb2608753 [0,2,0,0,0,0|0,0,1]=3 2101 B15R1.578 CCOC(=O)C(Br)C(Br)c1ccccc1 Amb2726210 [0,2,0,0,0,0|0,0,2]=4 2102 B15R1.578 CCOC(=O)C(C)C(=O)c1ccccc1 Amb10573089 [0,2,0,0,0,0|0,0,1]=3 2103 B15R1.578 CCOC(=O)C(C)C(N)c1ccccc1 Amb33740728 [0,2,0,0,0,0|0,0,2]=4 2104 B15R1.578 CCOC(=O)C(Cl)C(=O)c1ccccc1 Amb20247663 [0,2,0,0,0,0|0,0,1]=3 2105 B15R1.578 CCOC(=O)C(F)C(=O)c1ccccc1 Amb24065617 [0,2,0,0,0,0|0,0,1]=3 2106 B15R1.578 CCOC(=O)C(F)C(=O)c1ccccn1 Amb33470580 [0,2,0,0,0,0|1,0,1]=4 2107 B15R1.578 CCOC(=O)C(F)C(=O)c1ccncc1 Amb33470581 [0,2,0,0,0,0|1,0,1]=4 2108 B15R1.578 CCOC(=O)C(F)S(=O)c1ccccc1 Amb31031235 [0,2,0,0,0,0|1,0,1]=4 2109 B15R1.578 CCOC(=O)C(N)C(C)c1ccccc1 Amb33507320 [0,2,0,0,0,0|0,0,2]=4 2110 B15R1.578 CCOC(=O)C(N)C(O)c1ccccc1 Amb2697346 [0,2,0,0,0,0|0,0,2]=4 2111 B15R1.578 CCOC(=O)C(N)C(O)c1ccccc1 Amb33534208 [0,2,0,0,0,0|0,0,2]=4 2112 B15R1.578 CCOC(=O)C(O)C(N)c1ccccc1 Amb32753535 [0,2,0,0,0,0|0,0,2]=4 2113 B15R1.578 CCOC(=O)C(O)C(N)c1ccccc1 Amb32753536 [0,2,0,0,0,0|0,0,2]=4 2114 B15R1.578 CCOC(=O)C([NH3+])C(O)c1ccccc1 Amb4241318 [0,2,0,0,0,0|0,0,2]=4 2115 B15R1.578 CCOC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb32684474 [0,2,0,0,0,0|0,0,2]=4 2116 B15R1.578 CCOC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb32684475 [0,2,0,0,0,0|0,0,2]=4 2117 B15R1.578 CCOC(=O)[C@H](O)[C@H](N)c1ccccc1 Amb33872534 [0,2,0,0,0,0|0,0,2]=4 2118 B15R1.807 CCOC(=O)CC(C)(N)c1ccccc1 Amb23443928 [0,2,0,0,0,0|0,0,2]=4 2119 B15R1.807 CCOC(=O)CC(C)(N)c1ccccc1 Amb32729390 [0,2,0,0,0,0|0,0,2]=4 2120 B15R1.807 CCOC(=O)CC(C)(O)c1ccccc1 Amb4405322 [0,2,0,0,0,0|0,0,2]=4 2121 B15R1.807 CCOC(=O)CS(=O)(=O)c1ccccc1 Amb2408281 [0,2,0,0,0,0|1,0,1]=4 2122 B15R1.807 CCOC(=O)NS(=O)(=O)c1ccccc1 Amb10315 [0,2,0,0,0,0|2,0,0]=4 2123 B15R1.947 CCC(C)C(=O)CC(=O)c1ccccc1 Amb33355539 [0,2,0,0,0,0|1,0,1]=4 2124 B15R1.1076 CC(C)CC(=O)CC(=O)c1ccccc1 Amb9774977 [0,2,0,0,0,0|1,0,1]=4 2125 B15R1.1076 CC(C)OC(=O)CC(N)c1ccccc1 Amb1223231 [0,2,0,0,0,0|0,0,2]=4 2126 B15R1.1076 CC(C)OC(=O)CC(N)c1ccccc1 Amb2371491 [0,2,0,0,0,0|0,0,2]=4 2127 B15R1.1257 CCOC(=O)CC(CN)c1ccccc1 Amb8492585 [0,2,0,0,0,0|0,0,2]=4 2128 B15R1.1257 CCOC(=O)CN(C=O)c1ccccc1 Amb28991283 [0,2,0,0,0,0|1,0,1]=4 2129 B15R1.1257 CCOC(=O)NC(CN)c1ccccc1 Amb6662635 [0,2,0,0,0,0|1,0,1]=4 2130 B15R1.1257 CCOC(=O)\C=C(\CC)c1ccccc1 Amb10566528 [0,2,0,0,0,0|0,0,0]=2 2131 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Br Amb33291167 [0,2,0,0,0,0|1,0,1]=4 2132 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1C Amb33291149 [0,2,0,0,0,0|1,0,1]=4 2133 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1Cl Amb33291162 [0,2,0,0,0,0|1,0,1]=4 2134 B15R1.3722 CCCC(=O)CC(=O)c1ccccc1F Amb33291151 [0,2,0,0,0,0|1,0,1]=4 2135 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1Br Amb2685443 [0,2,0,0,0,0|0,0,1]=3 2136 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1C Amb2689993 [0,2,0,0,0,0|0,0,1]=3 2137 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1Cl Amb2686389 [0,2,0,0,0,0|0,0,1]=3 2138 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1F Amb2688373 [0,2,0,0,0,0|0,0,1]=3 2139 B15R1.3722 CCOC(=O)CC(=O)c1ccccc1I Amb6366280 [0,2,0,0,0,0|0,0,1]=3 2140 B15R1.3722 CCOC(=O)CC(=O)c1cccnc1Cl Amb19890663 [0,2,0,0,0,0|1,0,1]=4 2141 B15R1.3722 CCOC(=O)CC(=O)c1ncccc1C Amb32645672 [0,2,0,0,0,0|1,0,1]=4 2142 B15R1.3722 CCOC(=O)CC(N)c1ccccc1Br Amb1838051 [0,2,0,0,0,0|0,0,2]=4 2143 B15R1.3722 CCOC(=O)CC(N)c1ccccc1C Amb1838922 [0,2,0,0,0,0|0,0,2]=4 2144 B15R1.3722 CCOC(=O)CC(N)c1ccccc1C Amb20623539 [0,2,0,0,0,0|0,0,2]=4 2145 B15R1.3722 CCOC(=O)CC(N)c1ccccc1C Amb2234518 [0,2,0,0,0,0|0,0,2]=4 2146 B15R1.3722 CCOC(=O)CC(N)c1ccccc1Cl Amb1039538 [0,2,0,0,0,0|0,0,2]=4 2147 B15R1.3722 CCOC(=O)CC(N)c1ccccc1Cl Amb2708168 [0,2,0,0,0,0|0,0,2]=4 2148 B15R1.3722 CCOC(=O)CC(N)c1ccccc1F Amb2697330 [0,2,0,0,0,0|0,0,2]=4 2149 B15R1.3722 CCOC(=O)C[C@@H](N)c1ccccc1Cl Amb32674896 [0,2,0,0,0,0|0,0,2]=4 2150 B15R1.3722 CCOC(=O)C[C@@H](N)c1ccccc1Cl Amb32674898 [0,2,0,0,0,0|0,0,2]=4 2151 B15R1.3722 CCOC(=O)C[C@H](N)c1ccccc1C Amb24271685 [0,2,0,0,0,0|0,0,2]=4 2152 B15R1.3722 CCOC(=O)C[C@H](N)c1ccccc1C Amb33309140 [0,2,0,0,0,0|0,0,2]=4 2153 B15R1.3722 CCOC(=O)C[C@H](N)c1ccccc1Cl Amb33727220 [0,2,0,0,0,0|0,0,2]=4 2154 B15R1.3722 CCOC(=O)\C=C(\C)c1ccccc1Br Amb33493065 [0,2,0,0,0,0|0,0,0]=2 2155 B15R1.3722 CCOC(=O)\C=C(\C)c1ccccc1C Amb33493110 [0,2,0,0,0,0|0,0,0]=2 2156 B15R1.3722 CCOC(=O)\C=C(\C)c1ccccc1Cl Amb33492966 [0,2,0,0,0,0|0,0,0]=2 2157 B15R1.3722 CCOC(=O)\C=C(\C)c1ccccc1F Amb33493062 [0,2,0,0,0,0|0,0,0]=2 2158 B15R1.3722 CCOC(=O)\C=C(\C)c1cncnc1C Amb33493296 [0,2,0,0,0,0|2,0,0]=4 2159 B15R1.3722 CCOC(=O)\C=C(\C)c1nccnc1C Amb33493174 [0,2,0,0,0,0|2,0,0]=4 2160 B15R1.27 CCOC(=O)C#Cc1cccc(Br)c1F Amb25715091 [0,2,0,0,0,0|0,0,2]=4 2161 B15R1.27 CCOC(=O)C#Cc1cccc(Cl)c1C Amb32989976 [0,2,0,0,0,0|0,0,2]=4 2162 B15R1.27 CCOC(=O)C#Cc1cccc(Cl)c1Cl Amb26069524 [0,2,0,0,0,0|0,0,2]=4 2163 B15R1.27 CCOC(=O)C#Cc1cccc(F)c1F Amb27627764 [0,2,0,0,0,0|0,0,2]=4 2164 B15R1.27 CCOC(=O)CCc1cccc(N)c1C Amb32414189 [0,2,0,0,0,0|0,0,2]=4 2165 B15R1.27 CCOC(=O)\C=C\c1cccc(C)c1C Amb33357921 [0,2,0,0,0,0|0,0,0]=2 2166 B15R1.27 CCOC(=O)\C=C\c1cncc(C)c1C Amb32423927 [0,2,0,0,0,0|1,0,0]=3 2167 B15R1.49 CCOC(=O)C(=O)Nc1cc(C)ccn1 Amb6352408 [0,2,0,0,0,0|2,0,0]=4 2168 B15R1.49 CCOC(=O)C(=O)Nc1cccc(Br)c1 Amb3888468 [0,2,0,0,0,0|1,0,0]=3 2169 B15R1.49 CCOC(=O)C(=O)Nc1cccc(C)c1 Amb3439144 [0,2,0,0,0,0|1,0,0]=3 2170 B15R1.49 CCOC(=O)C(=O)Nc1cccc(C)n1 Amb3357020 [0,2,0,0,0,0|2,0,0]=4 2171 B15R1.49 CCOC(=O)C(=O)Nc1cccc(Cl)c1 Amb6334956 [0,2,0,0,0,0|1,0,0]=3 2172 B15R1.49 CCOC(=O)C(=O)Nc1cccc(F)c1 Amb3887165 [0,2,0,0,0,0|1,0,0]=3 2173 B15R1.49 CCOC(=O)C(=O)Nc1cncc(Cl)c1 Amb29864907 [0,2,0,0,0,0|2,0,0]=4 2174 B15R1.49 CCOC(=O)C(C)Oc1cccc(Br)c1 Amb30588471 [0,2,0,0,0,0|1,0,1]=4 2175 B15R1.49 CCOC(=O)C(C)Oc1cccc(C)c1 Amb2781007 [0,2,0,0,0,0|1,0,1]=4 2176 B15R1.49 CCOC(=O)C(C)Oc1cccc(N)c1 Amb23003534 [0,2,0,0,0,0|1,0,1]=4 2177 B15R1.49 CCOC(=O)C(C)Sc1cccc(Br)c1 Amb30588459 [0,2,0,0,0,0|1,0,1]=4 2178 B15R1.49 CCOC(=O)C(N)Cc1cccc(Br)c1 Amb3794011 [0,2,0,0,0,0|0,0,2]=4 2179 B15R1.49 CCOC(=O)C(N)Cc1cccc(Cl)c1 Amb28751023 [0,2,0,0,0,0|0,0,2]=4 2180 B15R1.49 CCOC(=O)C(N)Cc1cccc(Cl)c1 Amb3789825 [0,2,0,0,0,0|0,0,2]=4 2181 B15R1.49 CCOC(=O)C(N)Cc1cccc(F)c1 Amb31217626 [0,2,0,0,0,0|0,0,2]=4 2182 B15R1.49 CCOC(=O)C(N)Cc1cccc(F)c1 Amb3789094 [0,2,0,0,0,0|0,0,2]=4 2183 B15R1.49 CCOC(=O)C(N)Cc1cccc(O)c1 Amb33804288 [0,2,0,0,0,0|0,0,2]=4 2184 B15R1.49 CCOC(=O)C(O)Cc1cccc(Br)c1 Amb33422012 [0,2,0,0,0,0|0,0,2]=4 2185 B15R1.127 C=CCNC(=O)\C=C\c1cccc(N)c1 Amb17139869 [0,2,0,0,0,0|1,0,1]=4 2186 B15R1.127 CCCNC(=O)\C=C\c1cccc(N)c1 Amb17139962 [0,2,0,0,0,0|1,0,0]=3 2187 B15R1.1002 COC(=O)C(=O)\C=C\c1cccc(Br)c1 Amb21858951 [0,2,0,0,0,0|2,0,0]=4 2188 B15R1.1002 COC(=O)C(=O)\C=C\c1cccc(Cl)c1 Amb22584292 [0,2,0,0,0,0|2,0,0]=4 2189 B15R1.3858 CCOC(=O)C#Cc1cc(Br)ccc1Br Amb32990037 [0,2,0,0,0,0|0,0,2]=4 2190 B15R1.3858 CCOC(=O)C#Cc1cc(Br)ccc1Cl Amb32990039 [0,2,0,0,0,0|0,0,2]=4 2191 B15R1.3858 CCOC(=O)C#Cc1cc(Br)ccc1F Amb27864966 [0,2,0,0,0,0|0,0,2]=4 2192 B15R1.3858 CCOC(=O)C#Cc1cc(C)ccc1F Amb27817416 [0,2,0,0,0,0|0,0,2]=4 2193 B15R1.3858 CCOC(=O)C#Cc1cc(C)ccc1O Amb32990025 [0,2,0,0,0,0|0,0,2]=4 2194 B15R1.3858 CCOC(=O)C#Cc1cc(Cl)ccc1Cl Amb24459962 [0,2,0,0,0,0|0,0,2]=4 2195 B15R1.3858 CCOC(=O)C#Cc1cc(Cl)ccc1N Amb32989939 [0,2,0,0,0,0|0,0,2]=4 2196 B15R1.3858 CCOC(=O)C#Cc1cc(F)ccc1Cl Amb27949763 [0,2,0,0,0,0|0,0,2]=4 2197 B15R1.3858 CCOC(=O)C#Cc1cc(F)ccc1N Amb32989980 [0,2,0,0,0,0|0,0,2]=4 2198 B15R1.3858 CCOC(=O)C#Cc1cc(N)ccc1Br Amb32990015 [0,2,0,0,0,0|0,0,2]=4 2199 B15R1.3858 CCOC(=O)C#Cc1cc(N)ccc1C Amb32989931 [0,2,0,0,0,0|0,0,2]=4 2200 B15R1.3858 CCOC(=O)\C=C\c1cc(Br)ccc1N Amb28984083 [0,2,0,0,0,0|0,0,0]=2 2201 B15R1.3858 CCOC(=O)\C=C\c1cc(Br)cnc1F Amb33469178 [0,2,0,0,0,0|1,0,0]=3 2202 B15R1.3858 CCOC(=O)\C=C\c1cc(Br)cnc1N Amb9826859 [0,2,0,0,0,0|1,0,0]=3 2203 B15R1.3858 CCOC(=O)\C=C\c1cc(C)ccc1C Amb33358062 [0,2,0,0,0,0|0,0,0]=2 2204 B15R1.3858 CCOC(=O)\C=C\c1cc(C)ccc1F Amb33358089 [0,2,0,0,0,0|0,0,0]=2 2205 B15R1.3858 CCOC(=O)\C=C\c1cc(Cl)ccc1F Amb33358085 [0,2,0,0,0,0|0,0,0]=2 2206 B15R1.3858 CCOC(=O)\C=C\c1cc(F)ccc1C Amb33358090 [0,2,0,0,0,0|0,0,0]=2 2207 B15R1.3858 CCOC(=O)\C=C\c1cc(F)ccc1F Amb24095215 [0,2,0,0,0,0|0,0,0]=2 2208 B15R1.3858 CCOC(=O)\C=C\c1cc(F)ccc1O Amb22233770 [0,2,0,0,0,0|0,0,0]=2 2209 B15R1.8263 CC(C)NC(=O)\C=C\c1cccc(N)c1 Amb17139963 [0,2,0,0,0,0|1,0,0]=3 2210 B15R1.9720 CCOC(=O)CCc1cc(F)cc(F)c1 Amb24094064 [0,2,0,0,0,0|0,0,2]=4 2211 B15R1.9720 CCOC(=O)CNc1cc(C)cc(C)c1 Amb6712969 [0,2,0,0,0,0|1,0,1]=4 2212 B15R1.9720 CCOC(=O)CNc1cc(Cl)cc(Cl)c1 Amb2764674 [0,2,0,0,0,0|1,0,1]=4 2213 B15R1.9720 CCOC(=O)COc1cc(C)cc(C)c1 Amb6852649 [0,2,0,0,0,0|1,0,1]=4 2214 B15R1.9720 CCOC(=O)COc1cc(F)cc(Br)c1 Amb28963741 [0,2,0,0,0,0|1,0,1]=4 2215 B15R1.9720 CCOC(=O)\C=C\c1cc(Br)cc(Br)c1 Amb33358081 [0,2,0,0,0,0|0,0,0]=2 2216 B15R1.9720 CCOC(=O)\C=C\c1cc(C)cc(Br)c1 Amb33358092 [0,2,0,0,0,0|0,0,0]=2 2217 B15R1.9720 CCOC(=O)\C=C\c1cc(C)cc(C)c1 Amb33358082 [0,2,0,0,0,0|0,0,0]=2 2218 B15R1.9720 CCOC(=O)\C=C\c1cc(C)cc(F)c1 Amb33358084 [0,2,0,0,0,0|0,0,0]=2 2219 B15R1.9720 CCOC(=O)\C=C\c1cc(Cl)cc(Cl)c1 Amb32425181 [0,2,0,0,0,0|0,0,0]=2 2220 B15R1.9720 CCOC(=O)\C=C\c1cc(F)cc(F)c1 Amb2699639 [0,2,0,0,0,0|0,0,0]=2 2221 B15R1.9720 CCOC(=O)\C=C\c1nc(C)cc(C)n1 Amb30988229 [0,2,0,0,0,0|2,0,0]=4 2222 B15R1.10389 CCOC(=O)C#Cc1cccc(OC)c1 Amb24063547 [0,2,0,0,0,0|0,0,2]=4 2223 B15R1.10389 CCOC(=O)CCc1cccc(C=O)c1 Amb24073738 [0,2,0,0,0,0|0,0,2]=4 2224 B15R1.10389 CCOC(=O)CCc1cccc(CN)c1 Amb24073739 [0,2,0,0,0,0|0,0,2]=4 2225 B15R1.10389 CCOC(=O)CNc1cccc(C#N)c1 Amb6712115 [0,2,0,0,0,0|1,0,1]=4 2226 B15R1.10389 CCOC(=O)CNc1cccc(OC)c1 Amb1566487 [0,2,0,0,0,0|1,0,1]=4 2227 B15R1.10389 CCOC(=O)COc1cccc(C#N)c1 Amb6263794 [0,2,0,0,0,0|1,0,1]=4 2228 B15R1.10389 CCOC(=O)COc1cccc(C=O)c1 Amb837246 [0,2,0,0,0,0|1,0,1]=4 2229 B15R1.10389 CCOC(=O)COc1cccc(CN)c1 Amb1114496 [0,2,0,0,0,0|1,0,1]=4 2230 B15R1.10389 CCOC(=O)COc1cccc(CO)c1 Amb6706063 [0,2,0,0,0,0|1,0,1]=4 2231 B15R1.10389 CCOC(=O)COc1cccc(OC)c1 Amb7755248 [0,2,0,0,0,0|1,0,1]=4 2232 B15R1.10389 CCOC(=O)\C=C\c1cccc(OC)c1 Amb32751313 [0,2,0,0,0,0|0,0,0]=2 2233 B15R1.10389 CCOC(=O)\C=C\c1cccc(OC)n1 Amb33469189 [0,2,0,0,0,0|1,0,0]=3 2234 B15R1.10389 CCOC(=O)\C=C\c1cncc(OC)c1 Amb33715412 [0,2,0,0,0,0|1,0,0]=3 2235 B15R1.10390 CCNC(=O)\C=C\c1ccc(C)c(N)c1 Amb17139964 [0,2,0,0,0,0|1,0,0]=3 2236 B15R1.10390 CCNC(=O)\C=C\c1ccc(Cl)c(N)c1 Amb17141980 [0,2,0,0,0,0|1,0,0]=3 2237 B15R1.10390 CCNC(=O)\C=C\c1ccc(F)c(N)c1 Amb17140272 [0,2,0,0,0,0|1,0,0]=3 2238 B15R1.10390 CCOC(=O)C#Cc1ccc(Br)c(F)c1 Amb32989968 [0,2,0,0,0,0|0,0,2]=4 2239 B15R1.10390 CCOC(=O)C#Cc1ccc(C)c(C)c1 Amb28191388 [0,2,0,0,0,0|0,0,2]=4 2240 B15R1.10390 CCOC(=O)C#Cc1ccc(C)c(N)c1 Amb32989993 [0,2,0,0,0,0|0,0,2]=4 2241 B15R1.10390 CCOC(=O)C#Cc1ccc(Cl)c(N)c1 Amb32990010 [0,2,0,0,0,0|0,0,2]=4 2242 B15R1.10390 CCOC(=O)C#Cc1ccc(F)c(Br)c1 Amb32990022 [0,2,0,0,0,0|0,0,2]=4 2243 B15R1.10390 CCOC(=O)C#Cc1ccc(F)c(Cl)c1 Amb35713796 [0,2,0,0,0,0|0,0,2]=4 2244 B15R1.10390 CCOC(=O)C#Cc1ccc(F)c(F)c1 Amb24659812 [0,2,0,0,0,0|0,0,2]=4 2245 B15R1.10390 CCOC(=O)C#Cc1ccc(N)c(C)c1 Amb32989701 [0,2,0,0,0,0|0,0,2]=4 2246 B15R1.10390 CCOC(=O)C#Cc1ccc(N)c(Cl)c1 Amb32989986 [0,2,0,0,0,0|0,0,2]=4 2247 B15R1.10390 CCOC(=O)C#Cc1ccc(N)c(F)c1 Amb32989960 [0,2,0,0,0,0|0,0,2]=4 2248 B15R1.10390 CCOC(=O)CCc1ccc(F)c(F)c1 Amb24094053 [0,2,0,0,0,0|0,0,2]=4 2249 B15R1.10390 CCOC(=O)CCc1ccc(O)c(N)c1 Amb18656480 [0,2,0,0,0,0|0,0,2]=4 2250 B15R1.10390 CCOC(=O)CCc1ccc(O)c(O)c1 Amb4380126 [0,2,0,0,0,0|0,0,2]=4 2251 B15R1.10390 CCOC(=O)CNc1ccc(C)c(C)c1 Amb3371585 [0,2,0,0,0,0|1,0,1]=4 2252 B15R1.10390 CCOC(=O)CNc1ccc(F)c(Cl)c1 Amb2608742 [0,2,0,0,0,0|1,0,1]=4 2253 B15R1.10390 CCOC(=O)COc1ccc(C)c(C)c1 Amb6537553 [0,2,0,0,0,0|1,0,1]=4 2254 B15R1.10390 CCOC(=O)COc1ccc(Cl)c(C)c1 Amb6423535 [0,2,0,0,0,0|1,0,1]=4 2255 B15R1.10390 CCOC(=O)COc1ccc(N)c(C)c1 Amb1117597 [0,2,0,0,0,0|1,0,1]=4 2256 B15R1.10390 CCOC(=O)CSc1ccc(F)c(Cl)c1 Amb8995117 [0,2,0,0,0,0|1,0,1]=4 2257 B15R1.10390 CCOC(=O)\C=C\c1ccc(Br)c(F)c1 Amb34002764 [0,2,0,0,0,0|0,0,0]=2 2258 B15R1.10390 CCOC(=O)\C=C\c1ccc(Br)c(N)c1 Amb33358077 [0,2,0,0,0,0|0,0,0]=2 2259 B15R1.10390 CCOC(=O)\C=C\c1ccc(C)c(C)c1 Amb33358078 [0,2,0,0,0,0|0,0,0]=2 2260 B15R1.10390 CCOC(=O)\C=C\c1ccc(C)c(Cl)c1 Amb33358088 [0,2,0,0,0,0|0,0,0]=2 2261 B15R1.10390 CCOC(=O)\C=C\c1ccc(C)c(F)c1 Amb33358072 [0,2,0,0,0,0|0,0,0]=2 2262 B15R1.10390 CCOC(=O)\C=C\c1ccc(Cl)c(C)c1 Amb33358093 [0,2,0,0,0,0|0,0,0]=2 2263 B15R1.10390 CCOC(=O)\C=C\c1ccc(Cl)c(N)c1 Amb33358073 [0,2,0,0,0,0|0,0,0]=2 2264 B15R1.10390 CCOC(=O)\C=C\c1ccc(F)c(Br)c1 Amb33358079 [0,2,0,0,0,0|0,0,0]=2 2265 B15R1.10390 CCOC(=O)\C=C\c1ccc(F)c(C)c1 Amb33358060 [0,2,0,0,0,0|0,0,0]=2 2266 B15R1.10390 CCOC(=O)\C=C\c1ccc(F)c(Cl)c1 Amb32425180 [0,2,0,0,0,0|0,0,0]=2 2267 B15R1.10390 CCOC(=O)\C=C\c1ccc(F)c(F)c1 Amb2699638 [0,2,0,0,0,0|0,0,0]=2 2268 B15R1.10390 CCOC(=O)\C=C\c1cnc(C)c(C)c1 Amb32423936 [0,2,0,0,0,0|1,0,0]=3 2269 B15R1.10390 CCOC(=O)\C=C\c1cnc(N)c(C)c1 Amb33744739 [0,2,0,0,0,0|1,0,0]=3 2270 B15R1.48 C=C(Cc1ccc(Br)cc1)C(=O)OCC Amb21962853 [0,2,0,0,0,0|0,0,1]=3 2271 B15R1.48 CCNC(=O)C(=O)Nc1ccc(F)cc1 Amb3336682 [0,2,0,0,0,0|2,0,0]=4 2272 B15R1.48 CCOC(=O)C(=O)Cc1ccc(N)cc1 Amb34912769 [0,2,0,0,0,0|0,0,1]=3 2273 B15R1.48 CCOC(=O)C(=O)Nc1ccc(Br)cc1 Amb1934338 [0,2,0,0,0,0|1,0,0]=3 2274 B15R1.48 CCOC(=O)C(=O)Nc1ccc(Br)cn1 Amb28239827 [0,2,0,0,0,0|2,0,0]=4 2275 B15R1.48 CCOC(=O)C(=O)Nc1ccc(C)cc1 Amb6336457 [0,2,0,0,0,0|1,0,0]=3 2276 B15R1.48 CCOC(=O)C(=O)Nc1ccc(Cl)cc1 Amb2710445 [0,2,0,0,0,0|1,0,0]=3 2277 B15R1.48 CCOC(=O)C(=O)Nc1ccc(Cl)cn1 Amb22898851 [0,2,0,0,0,0|2,0,0]=4 2278 B15R1.48 CCOC(=O)C(=O)Nc1ccc(Cl)cn1 Amb2631433 [0,2,0,0,0,0|2,0,0]=4 2279 B15R1.48 CCOC(=O)C(=O)Nc1ccc(F)cc1 Amb6336458 [0,2,0,0,0,0|1,0,0]=3 2280 B15R1.48 CCOC(=O)C(Br)Cc1ccc(C)cc1 Amb2794055 [0,2,0,0,0,0|0,0,2]=4 2281 B15R1.48 CCOC(=O)C(Br)Cc1ccc(Cl)cc1 Amb345329 [0,2,0,0,0,0|0,0,2]=4 2282 B15R1.48 CCOC(=O)C(Br)Cc1ccc(F)cc1 Amb2794060 [0,2,0,0,0,0|0,0,2]=4 2283 B15R1.48 CCOC(=O)C(C)Cc1ccc(C)cc1 Amb28906011 [0,2,0,0,0,0|0,0,2]=4 2284 B15R1.48 CCOC(=O)C(C)Cc1ccc(F)cc1 Amb33038307 [0,2,0,0,0,0|0,0,2]=4 2285 B15R1.48 CCOC(=O)C(C)Cc1ccc(N)cc1 Amb22497560 [0,2,0,0,0,0|0,0,2]=4 2286 B15R1.48 CCOC(=O)C(C)Nc1ccc(F)cc1 Amb33729465 [0,2,0,0,0,0|1,0,1]=4 2287 B15R1.48 CCOC(=O)C(C)Oc1ccc(N)cc1 Amb32410612 [0,2,0,0,0,0|1,0,1]=4 2288 B15R1.48 CCOC(=O)C(C)Oc1ccc(O)cc1 Amb18656776 [0,2,0,0,0,0|1,0,1]=4 2289 B15R1.48 CCOC(=O)C(C)Sc1ccc(N)cc1 Amb33731846 [0,2,0,0,0,0|1,0,1]=4 2290 B15R1.48 CCOC(=O)C(Cl)Cc1ccc(Br)cc1 Amb23569633 [0,2,0,0,0,0|0,0,2]=4 2291 B15R1.48 CCOC(=O)C(N)Cc1ccc(Br)cc1 Amb33330591 [0,2,0,0,0,0|0,0,2]=4 2292 B15R1.48 CCOC(=O)C(N)Cc1ccc(Br)cc1 Amb3794012 [0,2,0,0,0,0|0,0,2]=4 2293 B15R1.48 CCOC(=O)C(N)Cc1ccc(C)cc1 Amb28751022 [0,2,0,0,0,0|0,0,2]=4 2294 B15R1.48 CCOC(=O)C(N)Cc1ccc(C)cc1 Amb3788903 [0,2,0,0,0,0|0,0,2]=4 2295 B15R1.48 CCOC(=O)C(N)Cc1ccc(Cl)cc1 Amb3789823 [0,2,0,0,0,0|0,0,2]=4 2296 B15R1.48 CCOC(=O)C(N)Cc1ccc(F)cc1 Amb3789093 [0,2,0,0,0,0|0,0,2]=4 2297 B15R1.48 CCOC(=O)C(N)Cc1ccc(I)cc1 Amb33465338 [0,2,0,0,0,0|0,0,2]=4 2298 B15R1.48 CCOC(=O)C(N)Cc1ccc(I)cc1 Amb3802607 [0,2,0,0,0,0|0,0,2]=4 2299 B15R1.48 CCOC(=O)C(N)Cc1ccc(O)cc1 Amb20247288 [0,2,0,0,0,0|0,0,2]=4 2300 B15R1.48 CCOC(=O)C(N)Cc1ccc(O)cc1 Amb22492786 [0,2,0,0,0,0|0,0,2]=4 2301 B15R1.48 CCOC(=O)C(N)Cc1ccc(O)cc1 Amb2697315 [0,2,0,0,0,0|0,0,2]=4 2302 B15R1.48 CCOC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb24113875 [0,2,0,0,0,0|0,0,2]=4 2303 B15R1.48 CCOC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb6365996 [0,2,0,0,0,0|0,0,2]=4 2304 B15R1.48 CCOC(=O)[C@@H](C)Oc1ccc(O)cc1 Amb15690580 [0,2,0,0,0,0|1,0,1]=4 2305 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb22232437 [0,2,0,0,0,0|0,0,2]=4 2306 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(Cl)cc1 Amb33804609 [0,2,0,0,0,0|0,0,2]=4 2307 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb16183972 [0,2,0,0,0,0|0,0,2]=4 2308 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb22799880 [0,2,0,0,0,0|0,0,2]=4 2309 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(I)cc1 Amb33804602 [0,2,0,0,0,0|0,0,2]=4 2310 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb2699028 [0,2,0,0,0,0|0,0,2]=4 2311 B15R1.48 CCOC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb3429361 [0,2,0,0,0,0|0,0,2]=4 2312 B15R1.48 CCOC(=O)[C@@H]([NH3+])Cc1ccc(O)cc1 Amb24113834 [0,2,0,0,0,0|0,0,2]=4 2313 B15R1.48 CCOC(=O)[C@H](C)Nc1ccc(Cl)cc1 Amb33744738 [0,2,0,0,0,0|1,0,1]=4 2314 B15R1.48 CCOC(=O)[C@H](N)Cc1ccc(Br)cc1 Amb33727302 [0,2,0,0,0,0|0,0,2]=4 2315 B15R1.48 CCOC(=O)[C@H](N)Cc1ccc(F)cc1 Amb33748213 [0,2,0,0,0,0|0,0,2]=4 2316 B15R1.48 CCOC(=O)[C@H](N)Cc1ccc(F)cc1 Amb33872235 [0,2,0,0,0,0|0,0,2]=4 2317 B15R1.48 CCOC(=O)[C@H](N)Cc1ccc(O)cc1 Amb8390424 [0,2,0,0,0,0|0,0,2]=4 2318 B15R1.48 CCOC(=O)[C@H](N)Cc1ccc(O)cc1 Amb9786456 [0,2,0,0,0,0|0,0,2]=4 2319 B15R1.48 CCOC(=O)\C(C)=C\c1ccc(C)cc1 Amb32846814 [0,2,0,0,0,0|0,0,0]=2 2320 B15R1.496 CC(C)NC(=O)C(=O)Cc1ccccc1 Amb17403033 [0,2,0,0,0,0|1,0,1]=4 2321 B15R1.496 CC(C)OC(=O)C(=O)Nc1ccccc1 Amb1196009 [0,2,0,0,0,0|1,0,0]=3 2322 B15R1.496 CC(C)OC(=O)C(N)Cc1ccccc1 Amb22741100 [0,2,0,0,0,0|0,0,2]=4 2323 B15R1.496 CC(C)OC(=O)C(N)Cc1ccccc1 Amb9493119 [0,2,0,0,0,0|0,0,2]=4 2324 B15R1.551 CCCOC(=O)N(C)Cc1ccccc1 Amb3101963 [0,2,0,0,0,0|1,0,1]=4 2325 B15R1.551 NCCNC(=O)C(=O)Nc1ccccc1 Amb8948896 [0,2,0,0,0,0|2,0,0]=4 2326 B15R1.551 O=C(NCCO)C(=O)Nc1ccccc1 Amb1813199 [0,2,0,0,0,0|2,0,0]=4 2327 B15R1.640 CCOC(=O)C(C#N)Cc1ccccc1 Amb10554262 [0,2,0,0,0,0|0,0,2]=4 2328 B15R1.640 CCOC(=O)C(C=O)Cc1ccccc1 Amb23441824 [0,2,0,0,0,0|0,0,2]=4 2329 B15R1.640 CCOC(=O)C(CN)Cc1ccccc1 Amb13951247 [0,2,0,0,0,0|0,0,2]=4 2330 B15R1.640 CCOC(=O)C(CN)Cc1ccccc1 Amb7801054 [0,2,0,0,0,0|0,0,2]=4 2331 B15R1.640 CCOC(=O)C(Cc1ccccc1)NC Amb19287768 [0,2,0,0,0,0|0,0,2]=4 2332 B15R1.640 CCOC(=O)C(Cc1ccccc1)NC Amb22058808 [0,2,0,0,0,0|0,0,2]=4 2333 B15R1.640 CCOC(=O)[C@@H](Cc1ccccc1)NC Amb33803412 [0,2,0,0,0,0|0,0,2]=4 2334 B15R1.640 CCOC(=O)[C@H](Cc1ccccc1)NC Amb33802732 [0,2,0,0,0,0|0,0,2]=4 2335 B15R1.640 CCOC(=O)\C(C#N)=C/c1ccccc1 Amb6541093 [0,2,0,0,0,0|0,0,0]=2 2336 B15R1.640 CCOC(=O)\C(C#N)=C/c1cccnc1 Amb7173700 [0,2,0,0,0,0|1,0,0]=3 2337 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccccc1 Amb4020041 [0,2,0,0,0,0|0,0,0]=2 2338 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccccn1 Amb3374029 [0,2,0,0,0,0|1,0,0]=3 2339 B15R1.640 CCOC(=O)\C(C#N)=C\c1cccnc1 Amb24077182 [0,2,0,0,0,0|1,0,0]=3 2340 B15R1.640 CCOC(=O)\C(C#N)=C\c1ccncc1 Amb3205411 [0,2,0,0,0,0|1,0,0]=3 2341 B15R1.3960 CCOC(=O)C(=O)Nc1ccccc1Br Amb6343162 [0,2,0,0,0,0|1,0,0]=3 2342 B15R1.3960 CCOC(=O)C(=O)Nc1ccccc1C Amb6348099 [0,2,0,0,0,0|1,0,0]=3 2343 B15R1.3960 CCOC(=O)C(=O)Nc1ccccc1Cl Amb3887426 [0,2,0,0,0,0|1,0,0]=3 2344 B15R1.3960 CCOC(=O)C(=O)Nc1ccccc1F Amb3887166 [0,2,0,0,0,0|1,0,0]=3 2345 B15R1.3960 CCOC(=O)C(=O)Nc1ncccc1Br Amb28241567 [0,2,0,0,0,0|2,0,0]=4 2346 B15R1.3960 CCOC(=O)C(=O)Nc1ncccc1C Amb4311167 [0,2,0,0,0,0|2,0,0]=4 2347 B15R1.3960 CCOC(=O)C(Br)Cc1ccccc1Cl Amb345331 [0,2,0,0,0,0|0,0,2]=4 2348 B15R1.3960 CCOC(=O)C(C)Cc1ccccc1C Amb32668287 [0,2,0,0,0,0|0,0,2]=4 2349 B15R1.3960 CCOC(=O)C(C)Oc1ccccc1Br Amb1945538 [0,2,0,0,0,0|1,0,1]=4 2350 B15R1.3960 CCOC(=O)C(C)Oc1ccccc1Cl Amb6515303 [0,2,0,0,0,0|1,0,1]=4 2351 B15R1.3960 CCOC(=O)C(N)Cc1ccccc1Br Amb3794013 [0,2,0,0,0,0|0,0,2]=4 2352 B15R1.3960 CCOC(=O)C(N)Cc1ccccc1Cl Amb33540719 [0,2,0,0,0,0|0,0,2]=4 2353 B15R1.3960 CCOC(=O)C(N)Cc1ccccc1F Amb2234848 [0,2,0,0,0,0|0,0,2]=4 2354 B15R1.3960 CCOC(=O)C(N)Cc1ccccc1F Amb2236938 [0,2,0,0,0,0|0,0,2]=4 2355 B15R1.3960 CCOC(=O)[C@@H](C)Oc1ccccc1I Amb22746601 [0,2,0,0,0,0|1,0,1]=4 2356 B15R1.10540 CCOC(=O)C(C)(C)Nc1ccccc1 Amb33737547 [0,2,0,0,0,0|1,0,1]=4 2357 B15R1.10540 CCOC(=O)C(C)(C)Oc1ccccc1 Amb6551122 [0,2,0,0,0,0|1,0,1]=4 2358 B15R1.10540 CCOC(=O)C(C)(N)Cc1ccccc1 Amb19317151 [0,2,0,0,0,0|0,0,2]=4 2359 B15R1.78 C#CCCNC(=O)\C=C\c1ccccc1 Amb21942377 [0,2,0,0,0,0|1,0,0]=3 2360 B15R1.78 CCCCOC(=O)NCc1ccccc1 Amb3106123 [0,2,0,0,0,0|1,0,1]=4 2361 B15R1.78 CCCCOC(=O)\C=C\c1ccccc1 Amb8392073 [0,2,0,0,0,0|0,0,0]=2 2362 B15R1.78 CCCONC(=O)NCc1ccccc1 Amb28326072 [0,2,0,0,0,0|1,0,1]=4 2363 B15R1.78 CCONCC(=O)NCc1ccccc1 Amb27803570 [0,2,0,0,0,0|1,0,1]=4 2364 B15R1.78 CCO\C=C\C(=O)NCc1ccccc1 Amb27828170 [0,2,0,0,0,0|1,0,1]=4 2365 B15R1.78 COCCOC(=O)NCc1ccccc1 Amb26637588 [0,2,0,0,0,0|1,0,1]=4 2366 B15R1.78 NCCCNC(=O)\C=C\c1ccccc1 Amb32652076 [0,2,0,0,0,0|1,0,0]=3 2367 B15R1.78 NCCCNC(=O)\C=C\c1ccccc1 Amb32652077 [0,2,0,0,0,0|1,0,0]=3 2368 B15R1.78 NCCOCC(=O)OCc1ccccc1 Amb27412669 [0,2,0,0,0,0|1,0,1]=4 2369 B15R1.78 O=C(NCc1ccccc1)OCCCBr Amb28388474 [0,2,0,0,0,0|1,0,1]=4 2370 B15R1.78 O=C(\C=C\c1ccccc1)NCCCO Amb5799195 [0,2,0,0,0,0|1,0,0]=3 2371 B15R1.139 Cc1ccc(\C=C\C(=O)NCCN)cc1 Amb18619939 [0,2,0,0,0,0|1,0,0]=3 2372 B15R1.741 C#CC(C)OC(=O)NCc1ccccc1 Amb27767152 [0,2,0,0,0,0|1,0,1]=4 2373 B15R1.741 CCC(C)OC(=O)NCc1ccccc1 Amb28058365 [0,2,0,0,0,0|1,0,1]=4 2374 B15R1.741 CC[C@H](C)OC(=O)NCc1ccccc1 Amb27784877 [0,2,0,0,0,0|1,0,1]=4 2375 B15R1.741 COC(=O)CC(=O)\C=C\c1ccccc1 Amb34913397 [0,2,0,0,0,0|1,0,1]=4 2376 B15R1.5919 CC(C)COC(=O)\C=C\c1ccccc1 Amb4130358 [0,2,0,0,0,0|0,0,0]=2 2377 B15R1.5919 CN(C)\C=C\C(=O)\C=C\c1ccccc1 Amb2386553 [0,2,0,0,0,0|1,0,1]=4 2378 B15R1.5919 O=C(O)CNC(=O)\C=C\c1ccccc1 Amb6665535 [0,2,0,0,0,0|1,0,1]=4 2379 B15R1.5934 CCCNS(=O)(=O)\C=C\c1ccccc1 Amb18861 [0,2,0,0,0,0|2,0,0]=4 2380 B15R1.791 CCOC(=O)C#Cc1ccc(Br)cc1F Amb32989956 [0,2,0,0,0,0|0,0,2]=4 2381 B15R1.791 CCOC(=O)C#Cc1ccc(Br)cc1N Amb32990004 [0,2,0,0,0,0|0,0,2]=4 2382 B15R1.791 CCOC(=O)C#Cc1ccc(C)cc1C Amb28364440 [0,2,0,0,0,0|0,0,2]=4 2383 B15R1.791 CCOC(=O)C#Cc1ccc(Cl)cc1F Amb27167514 [0,2,0,0,0,0|0,0,2]=4 2384 B15R1.791 CCOC(=O)C#Cc1ccc(Cl)cc1N Amb32989998 [0,2,0,0,0,0|0,0,2]=4 2385 B15R1.791 CCOC(=O)C#Cc1ccc(F)cc1C Amb27775164 [0,2,0,0,0,0|0,0,2]=4 2386 B15R1.791 CCOC(=O)C#Cc1ccc(N)cc1Cl Amb32989941 [0,2,0,0,0,0|0,0,2]=4 2387 B15R1.791 CCOC(=O)C#Cc1ccc(O)cc1C Amb32990047 [0,2,0,0,0,0|0,0,2]=4 2388 B15R1.791 CCOC(=O)CCc1ccc(F)cc1Cl Amb24090121 [0,2,0,0,0,0|0,0,2]=4 2389 B15R1.791 CCOC(=O)CCc1ccc(N)cc1C Amb32413531 [0,2,0,0,0,0|0,0,2]=4 2390 B15R1.791 CCOC(=O)CCc1ccc(N)cc1F Amb22301504 [0,2,0,0,0,0|0,0,2]=4 2391 B15R1.791 CCOC(=O)CCc1ccc(O)cc1C Amb22232483 [0,2,0,0,0,0|0,0,2]=4 2392 B15R1.791 CCOC(=O)CCc1ccc(O)cc1F Amb22749471 [0,2,0,0,0,0|0,0,2]=4 2393 B15R1.791 CCOC(=O)CNc1ccc(Br)cc1C Amb6709139 [0,2,0,0,0,0|1,0,1]=4 2394 B15R1.791 CCOC(=O)CNc1ccc(F)cc1F Amb6712907 [0,2,0,0,0,0|1,0,1]=4 2395 B15R1.791 CCOC(=O)CNc1ccc(F)cc1O Amb30623473 [0,2,0,0,0,0|1,0,1]=4 2396 B15R1.791 CCOC(=O)CNc1ccc(I)cc1C Amb8470291 [0,2,0,0,0,0|1,0,1]=4 2397 B15R1.791 CCOC(=O)COc1ccc(Br)cc1F Amb7755275 [0,2,0,0,0,0|1,0,1]=4 2398 B15R1.791 CCOC(=O)COc1ccc(C)cc1C Amb6852023 [0,2,0,0,0,0|1,0,1]=4 2399 B15R1.791 CCOC(=O)COc1ccc(Cl)cc1Br Amb4410463 [0,2,0,0,0,0|1,0,1]=4 2400 B15R1.791 CCOC(=O)COc1ccc(Cl)cc1C Amb6768999 [0,2,0,0,0,0|1,0,1]=4 2401 B15R1.791 CCOC(=O)COc1ccc(Cl)cc1Cl Amb9202860 [0,2,0,0,0,0|1,0,1]=4 2402 B15R1.791 CCOC(=O)COc1ccc(F)cc1Br Amb7755271 [0,2,0,0,0,0|1,0,1]=4 2403 B15R1.791 CCOC(=O)COc1ccc(F)cc1Cl Amb6547382 [0,2,0,0,0,0|1,0,1]=4 2404 B15R1.791 CCOC(=O)COc1ccc(F)cc1F Amb6548549 [0,2,0,0,0,0|1,0,1]=4 2405 B15R1.791 CCOC(=O)COc1ccc(N)cc1Cl Amb6259366 [0,2,0,0,0,0|1,0,1]=4 2406 B15R1.791 CCOC(=O)\C=C\c1ccc(Br)cc1C Amb23538448 [0,2,0,0,0,0|0,0,0]=2 2407 B15R1.791 CCOC(=O)\C=C\c1ccc(Br)cc1F Amb34002014 [0,2,0,0,0,0|0,0,0]=2 2408 B15R1.791 CCOC(=O)\C=C\c1ccc(C)cc1Br Amb23538449 [0,2,0,0,0,0|0,0,0]=2 2409 B15R1.791 CCOC(=O)\C=C\c1ccc(C)cc1C Amb33358076 [0,2,0,0,0,0|0,0,0]=2 2410 B15R1.791 CCOC(=O)\C=C\c1ccc(C)cc1F Amb33358086 [0,2,0,0,0,0|0,0,0]=2 2411 B15R1.791 CCOC(=O)\C=C\c1ccc(C)nc1C Amb32423846 [0,2,0,0,0,0|1,0,0]=3 2412 B15R1.791 CCOC(=O)\C=C\c1ccc(Cl)cc1Cl Amb17844467 [0,2,0,0,0,0|0,0,0]=2 2413 B15R1.791 CCOC(=O)\C=C\c1ccc(Cl)cc1N Amb21864581 [0,2,0,0,0,0|0,0,0]=2 2414 B15R1.791 CCOC(=O)\C=C\c1ccc(F)cc1C Amb33358087 [0,2,0,0,0,0|0,0,0]=2 2415 B15R1.791 CCOC(=O)\C=C\c1ccc(F)cc1F Amb24089400 [0,2,0,0,0,0|0,0,0]=2 2416 B15R1.791 CCOC(=O)\C=C\c1ccc(N)nc1C Amb33748686 [0,2,0,0,0,0|1,0,0]=3 2417 B15R1.791 CCOC(=O)\C=C\c1ccc(O)cc1F Amb22886993 [0,2,0,0,0,0|0,0,0]=2 2418 B15R1.791 CCOC(=O)\C=C\c1cnc(C)cc1C Amb32423757 [0,2,0,0,0,0|1,0,0]=3 2419 B15R1.793 CCOC(=O)C#Cc1ccc(OC)cc1 Amb22001838 [0,2,0,0,0,0|0,0,2]=4 2420 B15R1.793 CCOC(=O)CCc1ccc(C=O)cc1 Amb24066488 [0,2,0,0,0,0|0,0,2]=4 2421 B15R1.793 CCOC(=O)CCc1ccc(CC)cc1 Amb24078561 [0,2,0,0,0,0|0,0,2]=4 2422 B15R1.793 CCOC(=O)CCc1ccc(CN)cc1 Amb22754403 [0,2,0,0,0,0|0,0,2]=4 2423 B15R1.793 CCOC(=O)CCc1ccc(CO)cc1 Amb24184051 [0,2,0,0,0,0|0,0,2]=4 2424 B15R1.793 CCOC(=O)CNc1ccc(C#N)cc1 Amb6712839 [0,2,0,0,0,0|1,0,1]=4 2425 B15R1.793 CCOC(=O)CNc1ccc(CC)cc1 Amb6713160 [0,2,0,0,0,0|1,0,1]=4 2426 B15R1.793 CCOC(=O)CNc1ccc(OC)cc1 Amb6549558 [0,2,0,0,0,0|1,0,1]=4 2427 B15R1.793 CCOC(=O)COc1ccc(C#N)cc1 Amb1062502 [0,2,0,0,0,0|1,0,1]=4 2428 B15R1.793 CCOC(=O)COc1ccc(C=O)cc1 Amb6260661 [0,2,0,0,0,0|1,0,1]=4 2429 B15R1.793 CCOC(=O)COc1ccc(CO)cc1 Amb837452 [0,2,0,0,0,0|1,0,1]=4 2430 B15R1.793 CCOC(=O)COc1ccc(OC)cc1 Amb6335889 [0,2,0,0,0,0|1,0,1]=4 2431 B15R1.793 CCOC(=O)CSc1ccc(OC)cc1 Amb2433155 [0,2,0,0,0,0|1,0,1]=4 2432 B15R1.793 CCOC(=O)NCc1ccc(OC)cc1 Amb6498894 [0,2,0,0,0,0|1,0,1]=4 2433 B15R1.793 CCOC(=O)\C=C\c1ccc(C#N)cc1 Amb18653510 [0,2,0,0,0,0|0,0,0]=2 2434 B15R1.793 CCOC(=O)\C=C\c1ccc(C#N)cn1 Amb32661308 [0,2,0,0,0,0|1,0,0]=3 2435 B15R1.793 CCOC(=O)\C=C\c1ccc(CBr)cc1 Amb8396795 [0,2,0,0,0,0|0,0,0]=2 2436 B15R1.793 CCOC(=O)\C=C\c1ccc(CC)cc1 Amb23505019 [0,2,0,0,0,0|0,0,0]=2 2437 B15R1.793 CCOC(=O)\C=C\c1ccc(OC)cc1 Amb16236190 [0,2,0,0,0,0|0,0,0]=2 2438 B15R1.870 CC(C)OC(=O)NCc1ccc(N)cc1 Amb22059025 [0,2,0,0,0,0|1,0,1]=4 2439 B15R1.870 CC(C)OC(=O)NCc1ccc(N)cc1 Amb33547685 [0,2,0,0,0,0|1,0,1]=4 2440 B15R1.870 CC(C)OC(=O)\C=C\c1ccc(Cl)cc1 Amb17844462 [0,2,0,0,0,0|0,0,0]=2 2441 B15R1.1001 COC(=O)C(=O)\C=C\c1ccc(Br)cc1 Amb21856893 [0,2,0,0,0,0|2,0,0]=4 2442 B15R1.1001 CON(C)C(=O)\C=C\c1ccc(Cl)cc1 Amb20673761 [0,2,0,0,0,0|2,0,0]=4 2443 B15R1.130 CC(C)OC(=O)\C=C\c1ccccc1O Amb17844460 [0,2,0,0,0,0|0,0,0]=2 2444 B15R1.768 CCOC(=O)C#Cc1ccccc1CC Amb27869561 [0,2,0,0,0,0|0,0,2]=4 2445 B15R1.768 CCOC(=O)CCc1ccccc1C=O Amb24073741 [0,2,0,0,0,0|0,0,2]=4 2446 B15R1.768 CCOC(=O)CCc1ccccc1CN Amb33804737 [0,2,0,0,0,0|0,0,2]=4 2447 B15R1.768 CCOC(=O)CNc1ccccc1C#N Amb2414623 [0,2,0,0,0,0|1,0,1]=4 2448 B15R1.768 CCOC(=O)COc1ccccc1C#N Amb2099799 [0,2,0,0,0,0|1,0,1]=4 2449 B15R1.768 CCOC(=O)COc1ccccc1C=O Amb3361688 [0,2,0,0,0,0|1,0,1]=4 2450 B15R1.768 CCOC(=O)COc1ccccc1CC Amb9005122 [0,2,0,0,0,0|1,0,1]=4 2451 B15R1.768 CCOC(=O)COc1ccccc1OC Amb6357791 [0,2,0,0,0,0|1,0,1]=4 2452 B15R1.768 CCOC(=O)COc1ccccc1SC Amb22740086 [0,2,0,0,0,0|1,0,1]=4 2453 B15R1.768 CCOC(=O)\C=C\c1ccccc1C#N Amb33999755 [0,2,0,0,0,0|0,0,0]=2 2454 B15R1.768 CCOC(=O)\C=C\c1ccccc1C=O Amb6298684 [0,2,0,0,0,0|0,0,0]=2 2455 B15R1.768 CCOC(=O)\C=C\c1ccccc1CBr Amb5721933 [0,2,0,0,0,0|0,0,0]=2 2456 B15R1.768 CCOC(=O)\C=C\c1ccccc1CC Amb33358075 [0,2,0,0,0,0|0,0,0]=2 2457 B15R1.768 CCOC(=O)\C=C\c1ccccc1OC Amb33714754 [0,2,0,0,0,0|0,0,0]=2 2458 B15R1.768 CCOC(=O)\C=C\c1ccccc1OC Amb34002713 [0,2,0,0,0,0|0,0,0]=2 2459 B15R1.1323 COC(=O)C(=O)\C=C\c1ccccc1Br Amb21926826 [0,2,0,0,0,0|2,0,0]=4 2460 B15R1.36731 CCOC(=O)C#Cc1c(Cl)cccc1Br Amb27478448 [0,2,0,0,0,0|0,0,2]=4 2461 B15R1.36731 CCOC(=O)C#Cc1c(F)cccc1F Amb27440122 [0,2,0,0,0,0|0,0,2]=4 2462 B15R1.36731 CCOC(=O)C#Cc1c(O)cccc1F Amb32990041 [0,2,0,0,0,0|0,0,2]=4 2463 B15R1.36731 CCOC(=O)CCc1c(Cl)cccc1Br Amb23401462 [0,2,0,0,0,0|0,0,2]=4 2464 B15R1.36731 CCOC(=O)CCc1c(F)cccc1Cl Amb23603712 [0,2,0,0,0,0|0,0,2]=4 2465 B15R1.36731 CCOC(=O)CNc1c(C)cccc1C Amb33744737 [0,2,0,0,0,0|1,0,1]=4 2466 B15R1.36731 CCOC(=O)COc1c(Br)cccc1Br Amb9206348 [0,2,0,0,0,0|1,0,1]=4 2467 B15R1.36731 CCOC(=O)COc1c(C)cccc1C Amb6854416 [0,2,0,0,0,0|1,0,1]=4 2468 B15R1.36731 CCOC(=O)COc1c(Cl)cccc1Cl Amb6549376 [0,2,0,0,0,0|1,0,1]=4 2469 B15R1.36731 CCOC(=O)\C=C\c1c(C)cccc1C Amb33358053 [0,2,0,0,0,0|0,0,0]=2 2470 B15R1.36731 CCOC(=O)\C=C\c1c(Cl)cccc1Cl Amb3114736 [0,2,0,0,0,0|0,0,0]=2 2471 B15R1.36731 CCOC(=O)\C=C\c1c(F)cccc1F Amb30595086 [0,2,0,0,0,0|0,0,0]=2 2472 B15R1.36731 CCOC(=O)\C=C\c1c(N)ncnc1Cl Amb22235506 [0,2,0,0,0,0|2,0,0]=4 2473 B15R1.488 CCN(CC)C(=O)\C=C\c1ccccc1 Amb6384290 [0,2,0,0,0,0|1,0,0]=3 2474 B15R1.488 COC(OC)C(=O)\C=C\c1ccccc1 Amb32409877 [0,2,0,0,0,0|2,0,0]=4 2475 B15R1.3465 CC(C)(C)OC(=O)C#Cc1ccccc1 Amb25182423 [0,2,0,0,0,0|0,0,2]=4 2476 B15R1.3465 CC(C)(C)OC(=O)CNc1ccccc1 Amb19148099 [0,2,0,0,0,0|1,0,1]=4 2477 B15R1.3465 CC(C)(C)OC(=O)NCc1ccccc1 Amb6542547 [0,2,0,0,0,0|1,0,1]=4 2478 B15R1.3465 CC(C)(C)OC(=O)NNc1ccccc1 Amb9134563 [0,2,0,0,0,0|2,0,0]=4 2479 B15R1.3465 CC(C)(C)OC(=O)OCc1ccccc1 Amb27832763 [0,2,0,0,0,0|1,0,1]=4 2480 B15R1.3465 CC(C)(C)OC(=O)\C=C\c1ccccc1 Amb20671682 [0,2,0,0,0,0|0,0,0]=2 2481 B15R1.3465 CC(C)(C)OC(=O)\C=C\c1ccccn1 Amb33971121 [0,2,0,0,0,0|1,0,0]=3 2482 B15R1.3465 CC(C)(C)OC(=O)\C=C\c1cccnc1 Amb33469209 [0,2,0,0,0,0|1,0,0]=3 2483 B15R1.3465 CC(C)(C)OC(=O)\C=C\c1ccncc1 Amb33469127 [0,2,0,0,0,0|1,0,0]=3 2484 B15R1.3465 CC(C)(C)OC(=O)\N=C\c1ccccc1 Amb24627223 [0,2,0,0,0,0|1,0,0]=3 2485 B15R1.3983 CCOC(=CCc1ccccc1)OCC Amb22546882 [0,2,0,0,0,0|0,0,2]=4 2486 B15R1.3983 CCOC(\C=C\c1ccccc1)OCC Amb8629246 [0,2,0,0,0,0|0,0,2]=4 2487 B13R1.404 CCOC(=O)N\C=C/c1ccsc1 Amb27867310 [0,0,1,1,0,0|2,0,0]=4 2488 B13R1.404 CCOC(=O)N\C=C\c1ccco1 Amb27850068 [0,0,1,1,0,0|2,0,0]=4 2489 B13R1.404 CCOC(=O)\C=C\Nc1ccsc1 Amb29853825 [0,0,1,1,0,0|2,0,0]=4 2490 B13R1.464 C#Cc1ccccc1C(=O)OCC Amb26618200 [0,0,1,1,0,0|0,0,2]=4 2491 B13R1.464 C=C(OCC)c1ccccc1C=O Amb33136306 [0,0,1,1,0,0|2,0,0]=4 2492 B13R1.464 C=Cc1ccccc1C(=O)NCC Amb28195206 [0,0,1,1,0,0|1,0,0]=3 2493 B13R1.464 C=Cc1ccccc1C(=O)OCC Amb8394028 [0,0,1,1,0,0|0,0,0]=2 2494 B13R1.464 CCNC(=O)c1ccccc1C=O Amb25305984 [0,0,1,1,0,0|2,0,0]=4 2495 B13R1.464 CCOC(=O)c1ccccc1C#N Amb16230819 [0,0,1,1,0,0|1,0,1]=4 2496 B13R1.464 CCOC(=O)c1ccccc1C=O Amb8396096 [0,0,1,1,0,0|1,0,0]=3 2497 B13R1.464 CCOC(=O)c1ccccc1CBr Amb10071455 [0,0,1,1,0,0|1,0,1]=4 2498 B13R1.464 CCOC(=O)c1ccccc1CCl Amb8384485 [0,0,1,1,0,0|1,0,1]=4 2499 B13R1.464 CCOC(=O)c1ccccc1CI Amb24061261 [0,0,1,1,0,0|1,0,1]=4 2500 B13R1.464 CCOC(=O)c1ccccc1CN Amb33737666 [0,0,1,1,0,0|1,0,1]=4 2501 B13R1.464 CCOC(=O)c1ccccc1NC Amb7755235 [0,0,1,1,0,0|1,0,1]=4 2502 B13R1.464 CCOC(=O)c1ccccc1NN Amb24359843 [0,0,1,1,0,0|2,0,0]=4 2503 B13R1.464 CCOC(=O)c1ccccc1OC Amb6357479 [0,0,1,1,0,0|1,0,1]=4 2504 B13R1.464 CCOC(=O)c1ccccc1[Zn]Br Amb6300104 [0,0,1,1,0,0|2,0,0]=4 2505 B13R1.464 CCOC(=O)c1ncccc1C=O Amb15695355 [0,0,1,1,0,0|2,0,0]=4 2506 B13R1.464 [C-]#[N+]c1ccccc1C(=O)OCC Amb19928641 [0,0,1,1,0,0|1,0,1]=4 2507 B13R1.567 CCOc1cccc(\C=C\C=O)c1 Amb17335118 [0,0,1,1,0,0|2,0,0]=4 2508 B13R1.361 C=CCc1ccc(C(=O)OCC)o1 Amb6299524 [0,0,1,1,0,0|1,0,1]=4 2509 B13R1.361 C=CCc1ccc(C(=O)OCC)s1 Amb6299516 [0,0,1,1,0,0|1,0,1]=4 2510 B13R1.460 C#Cc1cccc(C(=O)OCC)c1 Amb23412172 [0,0,1,1,0,0|0,0,2]=4 2511 B13R1.460 C=C(OCC)c1cccc(C=O)c1 Amb33136085 [0,0,1,1,0,0|2,0,0]=4 2512 B13R1.460 C=Cc1cccc(C(=O)NCC)c1 Amb33226282 [0,0,1,1,0,0|1,0,0]=3 2513 B13R1.460 C=Cc1cccc(C(=O)OCC)c1 Amb16185424 [0,0,1,1,0,0|0,0,0]=2 2514 B13R1.460 CCNC(=O)c1cccc(C=O)c1 Amb24066803 [0,0,1,1,0,0|2,0,0]=4 2515 B13R1.460 CCOC(=O)c1cccc(C#N)c1 Amb9243009 [0,0,1,1,0,0|1,0,1]=4 2516 B13R1.460 CCOC(=O)c1cccc(C=O)c1 Amb10807492 [0,0,1,1,0,0|1,0,0]=3 2517 B13R1.460 CCOC(=O)c1cccc(C=O)n1 Amb19889851 [0,0,1,1,0,0|2,0,0]=4 2518 B13R1.460 CCOC(=O)c1cccc(CBr)c1 Amb22002428 [0,0,1,1,0,0|1,0,1]=4 2519 B13R1.460 CCOC(=O)c1cccc(CC)c1 Amb34911646 [0,0,1,1,0,0|0,0,2]=4 2520 B13R1.460 CCOC(=O)c1cccc(CCl)c1 Amb10071038 [0,0,1,1,0,0|1,0,1]=4 2521 B13R1.460 CCOC(=O)c1cccc(CN)c1 Amb22499039 [0,0,1,1,0,0|1,0,1]=4 2522 B13R1.460 CCOC(=O)c1cccc(NC)c1 Amb19037540 [0,0,1,1,0,0|1,0,1]=4 2523 B13R1.460 CCOC(=O)c1cccc(NC)c1 Amb31145809 [0,0,1,1,0,0|1,0,1]=4 2524 B13R1.460 CCOC(=O)c1cccc(NN)c1 Amb10604175 [0,0,1,1,0,0|2,0,0]=4 2525 B13R1.460 CCOC(=O)c1cccc(NN)c1 Amb2699805 [0,0,1,1,0,0|2,0,0]=4 2526 B13R1.460 CCOC(=O)c1cccc(OC)c1 Amb4302708 [0,0,1,1,0,0|1,0,1]=4 2527 B13R1.460 CCOC(=O)c1cccc([Zn]I)c1 Amb22000407 [0,0,1,1,0,0|2,0,0]=4 2528 B13R1.460 CCOC(=O)c1ccnc(C=O)c1 Amb21857369 [0,0,1,1,0,0|2,0,0]=4 2529 B13R1.77 CCOc1ccc(\C=C\C=O)cc1 Amb17335119 [0,0,1,1,0,0|2,0,0]=4 2530 B13R1.446 CCOC(=O)c1cc(Br)ccc1Br Amb27667864 [0,0,1,1,0,0|2,0,0]=4 2531 B13R1.446 CCOC(=O)c1cc(Br)ccc1C Amb16232898 [0,0,1,1,0,0|1,0,1]=4 2532 B13R1.446 CCOC(=O)c1cc(Br)ccc1Cl Amb2725505 [0,0,1,1,0,0|2,0,0]=4 2533 B13R1.446 CCOC(=O)c1cc(Br)ccc1F Amb9273799 [0,0,1,1,0,0|2,0,0]=4 2534 B13R1.446 CCOC(=O)c1cc(Br)ccc1I Amb19888237 [0,0,1,1,0,0|2,0,0]=4 2535 B13R1.446 CCOC(=O)c1cc(Br)ccc1N Amb2695801 [0,0,1,1,0,0|2,0,0]=4 2536 B13R1.446 CCOC(=O)c1cc(Br)ccc1O Amb6541244 [0,0,1,1,0,0|2,0,0]=4 2537 B13R1.446 CCOC(=O)c1cc(C)ccc1Br Amb27225001 [0,0,1,1,0,0|1,0,1]=4 2538 B13R1.446 CCOC(=O)c1cc(C)ccc1C Amb9242939 [0,0,1,1,0,0|0,0,2]=4 2539 B13R1.446 CCOC(=O)c1cc(C)ccc1Cl Amb22750100 [0,0,1,1,0,0|1,0,1]=4 2540 B13R1.446 CCOC(=O)c1cc(C)ccc1F Amb18187070 [0,0,1,1,0,0|1,0,1]=4 2541 B13R1.446 CCOC(=O)c1cc(C)ccc1I Amb10069354 [0,0,1,1,0,0|1,0,1]=4 2542 B13R1.446 CCOC(=O)c1cc(C)ccc1N Amb4450746 [0,0,1,1,0,0|1,0,1]=4 2543 B13R1.446 CCOC(=O)c1cc(C)ccc1O Amb3940892 [0,0,1,1,0,0|1,0,1]=4 2544 B13R1.446 CCOC(=O)c1cc(C)ccc1S Amb27598004 [0,0,1,1,0,0|1,0,1]=4 2545 B13R1.446 CCOC(=O)c1cc(Cl)ccc1Br Amb24065402 [0,0,1,1,0,0|2,0,0]=4 2546 B13R1.446 CCOC(=O)c1cc(Cl)ccc1C Amb22750098 [0,0,1,1,0,0|1,0,1]=4 2547 B13R1.446 CCOC(=O)c1cc(Cl)ccc1Cl Amb6365863 [0,0,1,1,0,0|2,0,0]=4 2548 B13R1.446 CCOC(=O)c1cc(Cl)ccc1F Amb9273666 [0,0,1,1,0,0|2,0,0]=4 2549 B13R1.446 CCOC(=O)c1cc(Cl)ccc1I Amb16185428 [0,0,1,1,0,0|2,0,0]=4 2550 B13R1.446 CCOC(=O)c1cc(Cl)ccc1N Amb2695805 [0,0,1,1,0,0|2,0,0]=4 2551 B13R1.446 CCOC(=O)c1cc(Cl)ccc1O Amb9243055 [0,0,1,1,0,0|2,0,0]=4 2552 B13R1.446 CCOC(=O)c1cc(F)ccc1Br Amb9273658 [0,0,1,1,0,0|2,0,0]=4 2553 B13R1.446 CCOC(=O)c1cc(F)ccc1C Amb18805490 [0,0,1,1,0,0|1,0,1]=4 2554 B13R1.446 CCOC(=O)c1cc(F)ccc1Cl Amb26645236 [0,0,1,1,0,0|2,0,0]=4 2555 B13R1.446 CCOC(=O)c1cc(F)ccc1F Amb9273814 [0,0,1,1,0,0|2,0,0]=4 2556 B13R1.446 CCOC(=O)c1cc(F)ccc1I Amb26995715 [0,0,1,1,0,0|2,0,0]=4 2557 B13R1.446 CCOC(=O)c1cc(F)ccc1N Amb7755320 [0,0,1,1,0,0|2,0,0]=4 2558 B13R1.446 CCOC(=O)c1cc(F)ccc1O Amb10576342 [0,0,1,1,0,0|2,0,0]=4 2559 B13R1.446 CCOC(=O)c1cc(F)ccc1S Amb22337257 [0,0,1,1,0,0|2,0,0]=4 2560 B13R1.446 CCOC(=O)c1cc(I)ccc1Br Amb19888257 [0,0,1,1,0,0|2,0,0]=4 2561 B13R1.446 CCOC(=O)c1cc(I)ccc1C Amb16232911 [0,0,1,1,0,0|1,0,1]=4 2562 B13R1.446 CCOC(=O)c1cc(I)ccc1F Amb19887822 [0,0,1,1,0,0|2,0,0]=4 2563 B13R1.446 CCOC(=O)c1cc(I)ccc1N Amb10068700 [0,0,1,1,0,0|2,0,0]=4 2564 B13R1.446 CCOC(=O)c1cc(I)ccc1O Amb16232638 [0,0,1,1,0,0|2,0,0]=4 2565 B13R1.446 CCOC(=O)c1cc(N)ccc1Br Amb18294542 [0,0,1,1,0,0|2,0,0]=4 2566 B13R1.446 CCOC(=O)c1cc(N)ccc1C Amb18291232 [0,0,1,1,0,0|1,0,1]=4 2567 B13R1.446 CCOC(=O)c1cc(N)ccc1Cl Amb32646041 [0,0,1,1,0,0|2,0,0]=4 2568 B13R1.446 CCOC(=O)c1cc(N)ccc1Cl Amb844782 [0,0,1,1,0,0|2,0,0]=4 2569 B13R1.446 CCOC(=O)c1cc(N)ccc1F Amb18984956 [0,0,1,1,0,0|2,0,0]=4 2570 B13R1.446 CCOC(=O)c1cc(N)ccc1I Amb26880783 [0,0,1,1,0,0|2,0,0]=4 2571 B13R1.446 CCOC(=O)c1cc(N)ccc1N Amb18975485 [0,0,1,1,0,0|2,0,0]=4 2572 B13R1.446 CCOC(=O)c1cc(N)ccc1O Amb7762506 [0,0,1,1,0,0|2,0,0]=4 2573 B13R1.446 CCOC(=O)c1cc(O)ccc1C Amb28316392 [0,0,1,1,0,0|1,0,1]=4 2574 B13R1.446 CCOC(=O)c1cc(O)ccc1Cl Amb22001181 [0,0,1,1,0,0|2,0,0]=4 2575 B13R1.446 CCOC(=O)c1cc(O)ccc1F Amb26497993 [0,0,1,1,0,0|2,0,0]=4 2576 B13R1.446 CCOC(=O)c1cc(O)ccc1I Amb10553667 [0,0,1,1,0,0|2,0,0]=4 2577 B13R1.446 CCOC(=O)c1cc(O)ccc1N Amb18977547 [0,0,1,1,0,0|2,0,0]=4 2578 B13R1.446 CCOC(=O)c1cc(S)ccc1N Amb27477753 [0,0,1,1,0,0|2,0,0]=4 2579 B13R2.1 CCCc1ccc2ccccn12 Amb28145853 [1,0,0,1,0,0|2,0,0]=4 2580 B13R2.1 CCNc1coc2ccccc12 Amb25119969 [1,0,0,1,0,0|2,0,0]=4 2581 B13R2.1 CCNc1csc2ccccc12 Amb25820242 [1,0,0,1,0,0|2,0,0]=4 2582 B13R2.1 CCOc1coc2cccnc12 Amb27954718 [1,0,0,1,0,0|2,0,0]=4 2583 B13R2.1 CCOc1nsc2ccccc12 Amb27962492 [1,0,0,1,0,0|2,0,0]=4 2584 B13R2.1 OC\C=C1\C=Cc2ccccc21 Amb27651915 [1,0,0,1,0,0|2,0,0]=4 2585 B13R2.3 C1=C(c2ccccc2)CCCC1 Amb8513291 [1,0,0,1,0,0|1,0,1]=4 2586 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb1153094 [1,0,0,1,0,0|1,0,1]=4 2587 B13R2.3 C1=C(c2ccccc2)CCNC1 Amb535503 [1,0,0,1,0,0|1,0,1]=4 2588 B13R2.3 C1=C(c2ccccc2)CCOC1 Amb21960770 [1,0,0,1,0,0|0,0,1]=3 2589 B13R2.3 C1=C(c2ccccn2)CCOC1 Amb28188151 [1,0,0,1,0,0|1,0,1]=4 2590 B13R2.3 C1=C(c2cccnc2)CCOC1 Amb33077272 [1,0,0,1,0,0|1,0,1]=4 2591 B13R2.3 C1=C(c2ccncc2)CCOC1 Amb33077287 [1,0,0,1,0,0|1,0,1]=4 2592 B13R2.3 C1=CC(c2ccccc2)CCC1 Amb4035356 [1,0,0,1,0,0|1,0,1]=4 2593 B13R2.3 C1=CC(c2ccccc2)CC[NH2+]1 Amb24080270 [1,0,0,1,0,0|1,0,1]=4 2594 B13R2.15 Brc1occc1-c2ccccc2 Amb13884539 [1,0,0,1,0,0|1,0,1]=4 2595 B13R2.15 Cc1oncc1-c2ccccc2 Amb27243828 [1,0,0,1,0,0|1,0,1]=4 2596 B13R2.15 Cn1cccc1-c2ccccc2 Amb26311299 [1,0,0,1,0,0|2,0,0]=4 2597 B13R2.15 Cn1nccc1-c2ccccc2 Amb18787762 [1,0,0,1,0,0|2,0,0]=4 2598 B13R2.17 CC1OC1\C=C\c2ccccc2 Amb25328517 [1,0,0,1,0,0|0,0,1]=3 2599 B13R2.64 C(=C1/CCCN1)/c2ccccc2 Amb27814288 [1,0,0,1,0,0|2,0,0]=4 2600 B13R2.64 C(=C1/CCNC1)/c2ccccc2 Amb26544410 [1,0,0,1,0,0|1,0,1]=4 2601 B13R2.64 C(=C1CCCC1)c2ccccc2 Amb10606582 [1,0,0,1,0,0|1,0,1]=4 2602 B13R2.1613 BrCc1cccc2ccccc12 Amb33528731 [1,0,0,1,0,0|2,0,0]=4 2603 B13R2.1613 CC[n+]1cccc2ccccc21 Amb6366278 [1,0,0,1,0,0|1,0,0]=3 2604 B13R2.1613 CC[n+]1ccnc2ccccc21 Amb2609715 [1,0,0,1,0,0|2,0,0]=4 2605 B13R2.1613 CCc1cccc2ccccc12 Amb9787671 [1,0,0,1,0,0|1,0,0]=3 2606 B13R2.1613 CCc1cccc2cccnc12 Amb9677427 [1,0,0,1,0,0|2,0,0]=4 2607 B13R2.1613 CCc1ccnc2ccccc12 Amb24066048 [1,0,0,1,0,0|2,0,0]=4 2608 B13R2.1613 CNc1cccc2ccccc12 Amb22231332 [1,0,0,1,0,0|2,0,0]=4 2609 B13R2.1613 CNc1cccc2ccccc12 Amb33527990 [1,0,0,1,0,0|2,0,0]=4 2610 B13R2.1613 COc1cccc2ccccc12 Amb4317506 [1,0,0,1,0,0|2,0,0]=4 2611 B13R2.1613 CSc1cccc2ccccc12 Amb25869823 [1,0,0,1,0,0|2,0,0]=4 2612 B13R2.1613 ClCc1cccc2ccccc12 Amb2781485 [1,0,0,1,0,0|2,0,0]=4 2613 B13R2.1613 NCc1cccc2ccccc12 Amb1116902 [1,0,0,1,0,0|2,0,0]=4 2614 B13R2.1613 NCc1cccc2ccccc12 Amb19196789 [1,0,0,1,0,0|2,0,0]=4 2615 B13R2.1613 OCc1cccc2ccccc12 Amb3939082 [1,0,0,1,0,0|2,0,0]=4 2616 B13R2.1613 SCc1cccc2ccccc12 Amb6663443 [1,0,0,1,0,0|2,0,0]=4 2617 B13R2.1613 [NH3+]Cc1cccc2ccccc12 Amb33513002 [1,0,0,1,0,0|2,0,0]=4 2618 B13R2.2383 C(=C\C1CCN1)/c2ccccc2 Amb32954170 [1,0,0,1,0,0|1,0,1]=4 2619 B13R2.10 Brc1cc(-c2ccccc2)co1 Amb10600637 [1,0,0,1,0,0|1,0,1]=4 2620 B13R2.10 Brc1cc(-c2ccccc2)no1 Amb22491894 [1,0,0,1,0,0|2,0,0]=4 2621 B13R2.10 Cc1cc(-c2ccccc2)no1 Amb10553849 [1,0,0,1,0,0|2,0,0]=4 2622 B13R2.10 Clc1cc(-c2ccccc2)no1 Amb2615454 [1,0,0,1,0,0|2,0,0]=4 2623 B13R2.10 NC1=CC(c2ccccc2)=CC1 Amb27179592 [1,0,0,1,0,0|1,0,1]=4 2624 B13R2.10 NC1=CN(c2ccccc2)CC1 Amb3986221 [1,0,0,1,0,0|2,0,0]=4 2625 B13R2.10 NC1C=C(c2ccccc2)CC1 Amb27642483 [1,0,0,1,0,0|1,0,1]=4 2626 B13R2.10 Nc1cc(-c2ccccc2)co1 Amb10600638 [1,0,0,1,0,0|1,0,1]=4 2627 B13R2.10 Nc1cc(-c2ccccc2)no1 Amb1156941 [1,0,0,1,0,0|2,0,0]=4 2628 B13R2.10 O=C1C=C(c2ccccc2)CC1 Amb10669546 [1,0,0,1,0,0|0,0,0]=2 2629 B13R2.10 O=C1C=C(c2ccccc2)CN1 Amb25881513 [1,0,0,1,0,0|1,0,0]=3 2630 B13R2.10 O=C1C=C(c2ccccc2)CO1 Amb24633865 [1,0,0,1,0,0|0,0,0]=2 2631 B13R2.10 O=C1C=C(c2ccccc2)NN1 Amb18800327 [1,0,0,1,0,0|2,0,0]=4 2632 B13R2.10 O=C1C=C(c2ccccc2)SC1 Amb27164569 [1,0,0,1,0,0|1,0,0]=3 2633 B13R2.10 O=C1C=C(c2ccccc2)SS1 Amb19517525 [1,0,0,1,0,0|1,1,0]=4 2634 B13R2.10 O=C1C=C(c2ccccn2)CC1 Amb17138484 [1,0,0,1,0,0|1,0,0]=3 2635 B13R2.10 O=C1C=C(c2ccccn2)CS1 Amb2611798 [1,0,0,1,0,0|1,1,0]=4 2636 B13R2.10 O=C1C=C(c2cccnc2)CC1 Amb17138485 [1,0,0,1,0,0|1,0,0]=3 2637 B13R2.10 O=C1C=C(c2ccncc2)CC1 Amb17138486 [1,0,0,1,0,0|1,0,0]=3 2638 B13R2.10 O=C1C=C(c2cnccn2)CC1 Amb27438419 [1,0,0,1,0,0|2,0,0]=4 2639 B13R2.10 O=C1C=[N+](c2ccccc2)[N-]O1 Amb21934019 [1,0,0,1,0,0|2,0,0]=4 2640 B13R2.10 O=C1CC(c2ccccc2)=NO1 Amb622006 [1,0,0,1,0,0|1,0,1]=4 2641 B13R2.10 O=C1CC(c2ccccc2)CO1 Amb28280068 [1,0,0,1,0,0|0,0,2]=4 2642 B13R2.10 O=C1CCC(c2ccccc2)C1 Amb17138497 [1,0,0,1,0,0|0,0,2]=4 2643 B13R2.10 O=C1CCC(c2ccccc2)N1 Amb17470413 [1,0,0,1,0,0|1,0,1]=4 2644 B13R2.10 O=C1CCC(c2ccccc2)O1 Amb4393092 [1,0,0,1,0,0|1,0,1]=4 2645 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb32410134 [1,0,0,1,0,0|1,0,1]=4 2646 B13R2.10 O=C1CCN(c2ccccc2)C1 Amb33528256 [1,0,0,1,0,0|1,0,1]=4 2647 B13R2.10 O=C1CCN(c2ccccc2)N1 Amb6315525 [1,0,0,1,0,0|2,0,0]=4 2648 B13R2.10 O=C1CC[C@@H](c2ccccc2)C1 Amb24323281 [1,0,0,1,0,0|0,0,2]=4 2649 B13R2.10 O=C1CC[C@@H](c2ccccc2)N1 Amb27242426 [1,0,0,1,0,0|1,0,1]=4 2650 B13R2.10 O=C1CC[C@H](c2ccccc2)C1 Amb24484347 [1,0,0,1,0,0|0,0,2]=4 2651 B13R2.10 O=C1CC[C@H](c2ccccc2)N1 Amb27227911 [1,0,0,1,0,0|1,0,1]=4 2652 B13R2.10 O=C1CC[C@H](c2ccccc2)O1 Amb28437127 [1,0,0,1,0,0|1,0,1]=4 2653 B13R2.10 O=C1CN=C(c2ccccc2)N1 Amb17842816 [1,0,0,1,0,0|2,0,0]=4 2654 B13R2.10 O=C1CN=C(c2ccccc2)O1 Amb3987291 [1,0,0,1,0,0|2,0,0]=4 2655 B13R2.10 O=C1COC(c2ccccc2)=N1 Amb27606825 [1,0,0,1,0,0|2,0,0]=4 2656 B13R2.10 O=C1CSC(c2ccccc2)=N1 Amb16231550 [1,0,0,1,0,0|2,0,0]=4 2657 B13R2.10 O=C1CSC(c2ccccc2)=N1 Amb2384341 [1,0,0,1,0,0|2,0,0]=4 2658 B13R2.10 O=C1C[C@@H](c2ccccc2)CO1 Amb27451585 [1,0,0,1,0,0|0,0,2]=4 2659 B13R2.10 O=C1NC(c2ccccc2)=NO1 Amb18788105 [1,0,0,1,0,0|2,0,0]=4 2660 B13R2.10 O=C1NC(c2ccccc2)CO1 Amb6346517 [1,0,0,1,0,0|1,0,1]=4 2661 B13R2.10 O=C1N[C@@H](c2ccccc2)CO1 Amb6295901 [1,0,0,1,0,0|1,0,1]=4 2662 B13R2.10 O=C1N[C@H](c2ccccc2)CO1 Amb6295900 [1,0,0,1,0,0|1,0,1]=4 2663 B13R2.10 O=C1OCC(c2ccccc2)O1 Amb27790954 [1,0,0,1,0,0|1,0,1]=4 2664 B13R2.10 Oc1cc(-c2ccccc2)no1 Amb6889229 [1,0,0,1,0,0|1,0,1]=4 2665 B13R2.32 C=C1C(=O)C=Cc2ccccc21 Amb27270865 [1,0,0,1,0,0|0,0,2]=4 2666 B13R2.32 C=C1C=Cc2ccccc2N1C Amb25918137 [1,0,0,1,0,0|2,0,0]=4 2667 B13R2.32 CC1=C2C=CC=CC2=CNC1=O Amb27857230 [1,0,0,1,0,0|1,0,1]=4 2668 B13R2.32 CC1C(=O)CCc2ccccc21 Amb4605911 [1,0,0,1,0,0|0,0,2]=4 2669 B13R2.32 CN1C(=O)C=Cc2ccccc21 Amb19116112 [1,0,0,1,0,0|1,0,0]=3 2670 B13R2.32 CN1C(=O)C=Cc2cccnc21 Amb28365713 [1,0,0,1,0,0|2,0,0]=4 2671 B13R2.32 CN1C(=O)C=Cc2cnccc21 Amb22491898 [1,0,0,1,0,0|2,0,0]=4 2672 B13R2.32 CN1C(=O)C=Cc2ncccc21 Amb28254581 [1,0,0,1,0,0|2,0,0]=4 2673 B13R2.32 CN1C(=S)C=Cc2ccccc21 Amb19651670 [1,0,0,1,0,0|1,1,0]=4 2674 B13R2.32 C[n+]1c(I)ccc2ccccc21 Amb348184 [1,0,0,1,0,0|2,0,0]=4 2675 B13R2.32 C[n+]1c(N)ccc2ccccc21 Amb2609713 [1,0,0,1,0,0|2,0,0]=4 2676 B13R2.32 Cc1c(Br)ccc2ccccc12 Amb21929204 [1,0,0,1,0,0|1,0,1]=4 2677 B13R2.32 Cc1c(Cl)ccc2ccccc12 Amb26843093 [1,0,0,1,0,0|1,0,1]=4 2678 B13R2.32 Cc1c(F)ccc2ccccc12 Amb26880002 [1,0,0,1,0,0|1,0,1]=4 2679 B13R2.32 Cc1c(I)ccc2ccccc12 Amb26367182 [1,0,0,1,0,0|1,0,1]=4 2680 B13R2.32 Cc1c(N)ccc2ccccc12 Amb17593938 [1,0,0,1,0,0|1,0,1]=4 2681 B13R2.32 Cc1c(O)ccc2ccccc12 Amb4016608 [1,0,0,1,0,0|0,0,2]=4 2682 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb17843414 [1,0,0,1,0,0|2,0,0]=4 2683 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb2540178 [1,0,0,1,0,0|2,0,0]=4 2684 B13R2.32 Cc1ccc2ccccc2[n+]1C Amb4322944 [1,0,0,1,0,0|2,0,0]=4 2685 B13R2.32 Cc1ccc2ccccc2c1C Amb6297194 [1,0,0,1,0,0|1,0,1]=4 2686 B13R2.32 Cn1c(=N)ccc2ccccc21 Amb8439002 [1,0,0,1,0,0|2,0,0]=4 2687 B13R2.32 Cn1c(=O)cnc2ccccc21 Amb2612192 [1,0,0,1,0,0|2,0,0]=4 2688 B13R2.32 N=C1C(=O)C=Cc2ccccc21 Amb27227038 [1,0,0,1,0,0|1,0,1]=4 2689 B13R2.32 O=C1C=Cc2ccccc2C1=O Amb534349 [1,0,0,1,0,0|1,0,1]=4 2690 B13R2.32 O=C1C=Cc2ccccc2C1=S Amb27177701 [1,0,0,1,0,0|1,0,1]=4 2691 B13R2.32 O=C1C=Cc2ccccc2N1O Amb22723451 [1,0,0,1,0,0|2,0,0]=4 2692 B13R2.32 OC1C(=S)C=Cc2ccccc21 Amb26035492 [1,0,0,1,0,0|1,1,0]=4 2693 B13R2.33 O=C1C=Cc2ccccc2C=C1 Amb21952910 [1,0,0,1,0,0|0,0,2]=4 2694 B13R2.33 O=C1C=Cc2ccccc2CC1 Amb17593958 [1,0,0,1,0,0|0,0,0]=2 2695 B13R2.33 O=C1C=Cc2ccccc2CN1 Amb8630983 [1,0,0,1,0,0|1,0,0]=3 2696 B13R2.33 O=C1C=Cc2ccccc2OC1 Amb27175937 [1,0,0,1,0,0|1,0,0]=3 2697 B13R2.33 O=C1C=Nc2ccccc2CN1 Amb27643583 [1,0,0,1,0,0|2,0,0]=4 2698 B13R2.33 O=C1CCc2ccccc2CC1 Amb6359959 [1,0,0,1,0,0|0,0,2]=4 2699 B13R2.33 O=C1CCc2ccccc2CN1 Amb610462 [1,0,0,1,0,0|1,0,1]=4 2700 B13R2.33 O=C1CCc2ccccc2OC1 Amb26925695 [1,0,0,1,0,0|1,0,1]=4 2701 B13R2.33 O[C@@H]1C=Cc2ccccc2CC1 Amb27197625 [1,0,0,1,0,0|0,0,2]=4 2702 B13R2.57 BrCc1ccc2ccccc2c1 Amb2609043 [1,0,0,1,0,0|2,0,0]=4 2703 B13R2.57 BrCc1ccc2ccccc2n1 Amb21857522 [1,0,0,1,0,0|2,0,0]=4 2704 B13R2.57 BrCc1ccc2ccccc2n1 Amb8397282 [1,0,0,1,0,0|2,0,0]=4 2705 B13R2.57 CCC1C=Cc2ccccc2N1 Amb27949234 [1,0,0,1,0,0|1,0,1]=4 2706 B13R2.57 CC[n+]1ccc2ccccc2c1 Amb27649764 [1,0,0,1,0,0|2,0,0]=4 2707 B13R2.57 CCc1ccc2ccccc2c1 Amb6298320 [1,0,0,1,0,0|1,0,0]=3 2708 B13R2.57 CCc1ccc2ccccc2n1 Amb20667571 [1,0,0,1,0,0|1,0,0]=3 2709 B13R2.57 CCc1ccc2cccnc2c1 Amb24436476 [1,0,0,1,0,0|2,0,0]=4 2710 B13R2.57 CCc1ccc2cccnc2n1 Amb28141810 [1,0,0,1,0,0|2,0,0]=4 2711 B13R2.57 CCc1ccc2ccncc2c1 Amb19100642 [1,0,0,1,0,0|2,0,0]=4 2712 B13R2.57 CCc1ccc2cnccc2c1 Amb24091669 [1,0,0,1,0,0|2,0,0]=4 2713 B13R2.57 CCc1ccc2cnccc2n1 Amb24648881 [1,0,0,1,0,0|2,0,0]=4 2714 B13R2.57 CCc1ccc2ncccc2c1 Amb18355325 [1,0,0,1,0,0|2,0,0]=4 2715 B13R2.57 CCc1cnc2ccccc2c1 Amb15691863 [1,0,0,1,0,0|2,0,0]=4 2716 B13R2.57 CNc1ccc2ccccc2c1 Amb415893 [1,0,0,1,0,0|2,0,0]=4 2717 B13R2.57 CNc1ccc2ccccc2n1 Amb6627062 [1,0,0,1,0,0|2,0,0]=4 2718 B13R2.57 COc1cc2ccccc2cn1 Amb25861237 [1,0,0,1,0,0|2,0,0]=4 2719 B13R2.57 COc1ccc2ccccc2c1 Amb2610832 [1,0,0,1,0,0|1,0,0]=3 2720 B13R2.57 COc1ccc2ccccc2n1 Amb20171196 [1,0,0,1,0,0|1,0,0]=3 2721 B13R2.57 COc1ccc2cccnc2c1 Amb17617089 [1,0,0,1,0,0|2,0,0]=4 2722 B13R2.57 COc1ccc2cccnc2c1 Amb24183299 [1,0,0,1,0,0|2,0,0]=4 2723 B13R2.57 COc1ccc2cccnc2n1 Amb27624881 [1,0,0,1,0,0|2,0,0]=4 2724 B13R2.57 COc1ccc2ccncc2c1 Amb10610318 [1,0,0,1,0,0|2,0,0]=4 2725 B13R2.57 COc1ccc2ccncc2c1 Amb5638098 [1,0,0,1,0,0|2,0,0]=4 2726 B13R2.57 COc1ccc2cnccc2c1 Amb10071944 [1,0,0,1,0,0|2,0,0]=4 2727 B13R2.57 COc1ccc2cnccc2c1 Amb22236031 [1,0,0,1,0,0|2,0,0]=4 2728 B13R2.57 COc1ccc2ncccc2c1 Amb1156981 [1,0,0,1,0,0|2,0,0]=4 2729 B13R2.57 COc1ccc2ncccc2n1 Amb27453648 [1,0,0,1,0,0|2,0,0]=4 2730 B13R2.57 COc1cnc2ccccc2c1 Amb19957896 [1,0,0,1,0,0|2,0,0]=4 2731 B13R2.57 COc1ncc2ccccc2n1 Amb22745160 [1,0,0,1,0,0|2,0,0]=4 2732 B13R2.57 CSc1ccc2ccccc2c1 Amb2609071 [1,0,0,1,0,0|1,1,0]=4 2733 B13R2.57 CSc1ccc2ccccc2n1 Amb6477854 [1,0,0,1,0,0|1,1,0]=4 2734 B13R2.57 ClCc1ccc2ccccc2[nH+]1 Amb24113853 [1,0,0,1,0,0|2,0,0]=4 2735 B13R2.57 ClCc1ccc2ccccc2c1 Amb2796492 [1,0,0,1,0,0|2,0,0]=4 2736 B13R2.57 ClCc1ccc2ccccc2n1 Amb6892745 [1,0,0,1,0,0|2,0,0]=4 2737 B13R2.57 FCc1ccc2ccccc2c1 Amb28139672 [1,0,0,1,0,0|2,0,0]=4 2738 B13R2.57 ICc1ccc2ccccc2n1 Amb28141827 [1,0,0,1,0,0|2,0,0]=4 2739 B13R2.57 NCc1ccc2ccccc2c1 Amb1120053 [1,0,0,1,0,0|2,0,0]=4 2740 B13R2.57 NCc1ccc2ccccc2c1 Amb19957972 [1,0,0,1,0,0|2,0,0]=4 2741 B13R2.57 NCc1ccc2ccccc2c1 Amb7969859 [1,0,0,1,0,0|2,0,0]=4 2742 B13R2.57 NCc1ccc2ccccc2n1 Amb1139476 [1,0,0,1,0,0|2,0,0]=4 2743 B13R2.57 NCc1ccc2ccccc2n1 Amb15695438 [1,0,0,1,0,0|2,0,0]=4 2744 B13R2.57 NCc1ccc2ccccc2n1 Amb7990033 [1,0,0,1,0,0|2,0,0]=4 2745 B13R2.57 OCc1ccc2ccccc2c1 Amb2389960 [1,0,0,1,0,0|2,0,0]=4 2746 B13R2.57 OCc1ccc2ccccc2n1 Amb1154605 [1,0,0,1,0,0|2,0,0]=4 2747 B13R2.57 SCc1ccc2ccccc2c1 Amb21943705 [1,0,0,1,0,0|2,0,0]=4 2748 B13R2.57 SCc1ccc2ccccc2n1 Amb28200238 [1,0,0,1,0,0|2,0,0]=4 2749 B13R2.373 CC1C(=O)C=C1c2ccccc2 Amb27770129 [1,0,0,1,0,0|0,0,0]=2 2750 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [1,0,0,1,0,0|0,0,2]=4 2751 B13R2.373 CC1C(=O)CN1c2ccccc2 Amb27471934 [1,0,0,1,0,0|1,0,1]=4 2752 B13R2.373 CC1C(=O)NC1c2ccccc2 Amb19149073 [1,0,0,1,0,0|1,0,1]=4 2753 B13R2.373 C[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb28286725 [1,0,0,1,0,0|1,0,1]=4 2754 B13R2.373 C[C@H]1C(=O)N[C@H]1c2ccccc2 Amb27849042 [1,0,0,1,0,0|1,0,1]=4 2755 B13R2.373 O=C1C=C(c2ccccc2)C1=O Amb22172059 [1,0,0,1,0,0|1,0,1]=4 2756 B13R2.3203 CC1(\C=C\c2ccccc2)CO1 Amb33080798 [1,0,0,1,0,0|1,0,1]=4 2757 B13R2.3203 NC1(\C=C\c2ccccc2)CC1 Amb33081456 [1,0,0,1,0,0|1,0,1]=4 2758 B13R2.3203 OC1(\C=C/c2ccccc2)CC1 Amb26873373 [1,0,0,1,0,0|0,0,2]=4 2759 B13R2.3203 OC1(\C=C\c2ccccc2)CC1 Amb27967099 [1,0,0,1,0,0|0,0,2]=4 2760 B13R2.15272 CCC(=O)C1Cc2ccccc21 Amb28250023 [1,0,0,1,0,0|0,0,2]=4 2761 B13R2.15272 COC(=O)C1Cc2ccccc21 Amb27616823 [1,0,0,1,0,0|0,0,2]=4 2762 B13R2.26 CCCC1=Cc2ccccc2C1 Amb15692407 [0,0,0,1,1,0|2,0,0]=4 2763 B13R2.26 CCCc1cc2ccccc2o1 Amb8503548 [0,0,0,1,1,0|1,0,1]=4 2764 B13R2.26 CCCc1cc2ccccc2s1 Amb27980510 [0,0,0,1,1,0|1,1,0]=4 2765 B13R2.26 CCSc1cc2ccccc2s1 Amb28130052 [0,0,0,1,1,0|0,2,0]=4 2766 B13R2.30 CC1NC(=O)C1c2ccccc2 Amb26968702 [0,0,0,1,1,0|1,0,1]=4 2767 B13R2.135 CCC1C(=O)Cc2ccccc21 Amb28074726 [0,0,0,1,1,0|1,0,1]=4 2768 B13R2.135 CCC1C(=O)Nc2ccccc21 Amb33544575 [0,0,0,1,1,0|2,0,0]=4 2769 B13R2.135 CCC1C(=O)Sc2ccccc21 Amb28385109 [0,0,0,1,1,0|2,0,0]=4 2770 B13R2.135 CCN1C(=O)Cc2ccccc21 Amb2416954 [0,0,0,1,1,0|1,0,1]=4 2771 B13R2.135 CCN1C(=O)Nc2ccccc21 Amb18034265 [0,0,0,1,1,0|2,0,0]=4 2772 B13R2.135 CCN1C(=O)Oc2ccccc21 Amb17992087 [0,0,0,1,1,0|2,0,0]=4 2773 B13R2.135 CCn1c(C)cc2ccccc21 Amb6773014 [0,0,0,1,1,0|2,0,0]=4 2774 B13R2.138 CCC1=C(c2ccccc2)C1=O Amb27176039 [0,0,0,1,1,0|1,0,0]=3 2775 B13R2.138 COC1=C(c2ccccc2)C1=O Amb27748603 [0,0,0,1,1,0|2,0,0]=4 2776 B13R2.163 O=C1CCCc2ccccc2C1 Amb6360022 [0,0,0,1,1,0|1,0,1]=4 2777 B13R2.163 O=C1CCCc2ccccc2N1 Amb1077569 [0,0,0,1,1,0|2,0,0]=4 2778 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [0,0,0,1,1,0|2,0,0]=4 2779 B13R2.163 O=C1Cc2ccccc2CCN1 Amb16203437 [0,0,0,1,1,0|1,0,1]=4 2780 B13R2.163 O=C1NCCc2ccccc2N1 Amb25869873 [0,0,0,1,1,0|2,0,0]=4 2781 B13R2.328 CC1=C2C=CC=CC2=CC(=O)N1 Amb22371049 [0,0,0,1,1,0|1,0,1]=4 2782 B13R2.328 CC1CC(=O)Cc2ccccc21 Amb17594002 [0,0,0,1,1,0|1,0,1]=4 2783 B13R2.328 CC1CC(=O)Nc2ccccc21 Amb17836212 [0,0,0,1,1,0|2,0,0]=4 2784 B13R2.328 CC1CC(Br)=Cc2ccccc21 Amb27770920 [0,0,0,1,1,0|2,0,0]=4 2785 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,0,0,1,1,0|1,0,1]=4 2786 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,0,0,1,1,0|2,0,0]=4 2787 B13R2.444 O=C(Cc1ccccc1)C2CC2 Amb18034012 [0,0,0,1,1,0|1,0,1]=4 2788 B13R2.444 O=C(Nc1ccccc1)C2CC2 Amb3108112 [0,0,0,1,1,0|2,0,0]=4 2789 B13R2.444 O=C(Oc1ccccc1)C2CC2 Amb27178730 [0,0,0,1,1,0|2,0,0]=4 2790 B13R2.13 O=C1C=C(c2cccs2)CCC1 Amb27396292 [0,0,0,1,1,0|2,0,0]=4 2791 B13R2.13 O=C1C=C(n2cccc2)CCC1 Amb27267088 [0,0,0,1,1,0|2,0,0]=4 2792 B13R2.29 O=C1CCC\C1=C/c2ccco2 Amb24516615 [0,0,0,1,1,0|2,0,0]=4 2793 B13R2.29 O=C1CCC\C1=C/c2ccsc2 Amb28201104 [0,0,0,1,1,0|2,0,0]=4 2794 B13R2.29 O=C1CCC\C1=C\c2ccco2 Amb534156 [0,0,0,1,1,0|2,0,0]=4 2795 B13R2.29 O=C1CCC\C1=C\c2cccs2 Amb27599372 [0,0,0,1,1,0|2,0,0]=4 2796 B13R2.29 O=C1CCC\C1=C\c2ccsc2 Amb27859360 [0,0,0,1,1,0|2,0,0]=4 2797 B13R2.6970 O=C(\C=C\c1ccco1)C2CC2 Amb1033027 [0,0,0,1,1,0|2,0,0]=4 2798 B13R2.6970 O=C(\C=C\c1ccco1)N2CC2 Amb27946561 [0,0,0,1,1,0|2,0,0]=4 2799 B15R2.31 O=C1C=C(Cc2ccccc2)NCC1 Amb27482621 [0,0,0,1,0,1|2,0,0]=4 2800 B15R2.31 O=C1C=C(Cc2ccccn2)CCC1 Amb27806515 [0,0,0,1,0,1|2,0,0]=4 2801 B15R2.31 O=C1C=C(Nc2ccccc2)CCC1 Amb654719 [0,0,0,1,0,1|1,0,0]=3 2802 B15R2.31 O=C1C=C(Nc2ccccc2)COC1 Amb28128687 [0,0,0,1,0,1|2,0,0]=4 2803 B15R2.31 O=C1C=C(Nc2ccccn2)CCC1 Amb27614335 [0,0,0,1,0,1|2,0,0]=4 2804 B15R2.31 O=C1C=C(Nc2cccnc2)CCC1 Amb25224358 [0,0,0,1,0,1|2,0,0]=4 2805 B15R2.31 O=C1C=C(Nc2ccncc2)CCC1 Amb4453942 [0,0,0,1,0,1|2,0,0]=4 2806 B15R2.31 O=C1C=C(Oc2ccccc2)CCC1 Amb10565290 [0,0,0,1,0,1|1,0,0]=3 2807 B15R2.31 O=C1CC(Cc2ccccc2)CCO1 Amb27963030 [0,0,0,1,0,1|0,0,2]=4 2808 B15R2.31 O=C1CN(Cc2ccccc2)CCO1 Amb22490281 [0,0,0,1,0,1|0,0,2]=4 2809 B15R2.31 O=C1NC(Cc2ccccc2)CCO1 Amb8392176 [0,0,0,1,0,1|0,0,2]=4 2810 B15R2.55 O=C1CCC\C1=C/Nc2ccccc2 Amb4553137 [0,0,0,1,0,1|1,0,0]=3 2811 B15R2.55 O=C1CCC\C1=N/Nc2ccccc2 Amb27203920 [0,0,0,1,0,1|2,0,0]=4 2812 B15R2.55 O=C1CCC\C1=N\Nc2ccccc2 Amb19960024 [0,0,0,1,0,1|2,0,0]=4 2813 B15R2.55 O=C1CSC\C1=C/Nc2ccccc2 Amb27173726 [0,0,0,1,0,1|2,0,0]=4 2814 B15R2.55 O=C1OCC=C1NCc2ccccc2 Amb28193721 [0,0,0,1,0,1|0,0,2]=4 2815 B15R2.55 O=C1OCCN1C#Cc2ccccc2 Amb28133810 [0,0,0,1,0,1|0,0,2]=4 2816 B15R2.55 O=C1OCCN1\N=C\c2ccccn2 Amb2642236 [0,0,0,1,0,1|2,0,0]=4 2817 B15R2.55 O=C1OCC[C@@H]1NCc2ccccc2 Amb27256157 [0,0,0,1,0,1|0,0,2]=4 2818 B15R2.55 O=C1OCC\C1=C/Nc2ccccn2 Amb27391180 [0,0,0,1,0,1|1,0,0]=3 2819 B15R2.55 OC1=C(\C=N\c2ccccc2)CCN1 Amb28198864 [0,0,0,1,0,1|1,0,1]=4 2820 B15R2.66 CCCc1ccc(-c2ccccc2)o1 Amb28398533 [0,0,0,1,0,1|1,0,1]=4 2821 B15R2.66 CCCc1csc(-c2ccccc2)n1 Amb28072792 [0,0,0,1,0,1|2,0,0]=4 2822 B15R2.66 CCCc1nc(-c2ccccc2)cs1 Amb28340834 [0,0,0,1,0,1|2,0,0]=4 2823 B15R2.66 CCNc1ccn(-c2ccccc2)n1 Amb27660587 [0,0,0,1,0,1|2,0,0]=4 2824 B15R2.66 CCNc1nc(-c2ccccc2)co1 Amb22271127 [0,0,0,1,0,1|2,0,0]=4 2825 B15R2.66 CCOc1cc(-c2ccccc2)cs1 Amb26368758 [0,0,0,1,0,1|1,0,0]=3 2826 B15R2.66 CCOc1cc(-c2ccccc2)no1 Amb10566722 [0,0,0,1,0,1|2,0,0]=4 2827 B15R2.66 CCOc1ccn(-c2cccnc2)n1 Amb32657032 [0,0,0,1,0,1|2,0,0]=4 2828 B15R2.66 CCOc1ccn(-c2ccncc2)n1 Amb32657023 [0,0,0,1,0,1|2,0,0]=4 2829 B15R2.66 CCOc1cnc(-c2ccccc2)o1 Amb2415645 [0,0,0,1,0,1|0,0,1]=3 2830 B15R2.66 CCSc1nc(-c2ccccc2)cs1 Amb3135630 [0,0,0,1,0,1|1,1,0]=4 2831 B15R2.73 CCCC(=O)c1cnn2ccccc12 Amb27813779 [0,0,0,1,0,1|2,0,0]=4 2832 B15R2.73 CCCC(=O)c1ncn2ccccc12 Amb27242513 [0,0,0,1,0,1|2,0,0]=4 2833 B15R2.73 CCOC(=O)C1=C2C=CC=CN2NC1 Amb27805039 [0,0,0,1,0,1|1,0,1]=4 2834 B15R2.73 CCOC(=O)C1=CCc2ccccc21 Amb28315180 [0,0,0,1,0,1|0,0,0]=2 2835 B15R2.73 CCOC(=O)C1CCc2ccccc21 Amb26864787 [0,0,0,1,0,1|0,0,2]=4 2836 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb22276114 [0,0,0,1,0,1|0,0,2]=4 2837 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb25775070 [0,0,0,1,0,1|0,0,2]=4 2838 B15R2.73 CCOC(=O)C1COc2ccccc21 Amb22059418 [0,0,0,1,0,1|0,0,2]=4 2839 B15R2.73 CCOC(=O)C1NCc2ccccc21 Amb27239689 [0,0,0,1,0,1|0,0,2]=4 2840 B15R2.73 CCOC(=O)C1OCc2ccccc21 Amb27200681 [0,0,0,1,0,1|0,0,2]=4 2841 B15R2.73 CCOC(=O)N1CCc2ccccc21 Amb6370493 [0,0,0,1,0,1|0,0,2]=4 2842 B15R2.73 CCOC(=O)c1ccc2ccccn12 Amb23441244 [0,0,0,1,0,1|1,0,0]=3 2843 B15R2.73 CCOC(=O)c1ccn2ccccc12 Amb28118746 [0,0,0,1,0,1|1,0,0]=3 2844 B15R2.73 CCOC(=O)c1cnc2ccccn12 Amb17935911 [0,0,0,1,0,1|1,0,0]=3 2845 B15R2.73 CCOC(=O)c1cnc2cccnn12 Amb26470347 [0,0,0,1,0,1|2,0,0]=4 2846 B15R2.73 CCOC(=O)c1cnc2cnccn12 Amb23401670 [0,0,0,1,0,1|2,0,0]=4 2847 B15R2.73 CCOC(=O)c1cnc2ncccn12 Amb16230901 [0,0,0,1,0,1|2,0,0]=4 2848 B15R2.73 CCOC(=O)c1cnn2ccccc12 Amb2723396 [0,0,0,1,0,1|1,0,0]=3 2849 B15R2.73 CCOC(=O)c1cnn2cccnc12 Amb1945988 [0,0,0,1,0,1|2,0,0]=4 2850 B15R2.73 CCOC(=O)c1cnn2ccncc12 Amb22886646 [0,0,0,1,0,1|2,0,0]=4 2851 B15R2.73 CCOC(=O)c1cnn2ncccc12 Amb24330762 [0,0,0,1,0,1|2,0,0]=4 2852 B15R2.73 CCOC(=O)c1csc2ccccc12 Amb6497077 [0,0,0,1,0,1|0,0,0]=2 2853 B15R2.73 CCOC(=O)c1ncc2ccccn12 Amb22000980 [0,0,0,1,0,1|1,0,0]=3 2854 B15R2.73 CCOC(=O)c1ncc2cnccn12 Amb24098087 [0,0,0,1,0,1|2,0,0]=4 2855 B15R2.73 CCOC(=O)c1ncc2ncccn12 Amb28369817 [0,0,0,1,0,1|2,0,0]=4 2856 B15R2.73 CCOC(=O)c1ncn2ccccc12 Amb21857852 [0,0,0,1,0,1|1,0,0]=3 2857 B15R2.73 CCOC(=O)c1ncn2cccnc12 Amb27262701 [0,0,0,1,0,1|2,0,0]=4 2858 B15R2.73 CCOC(=O)c1ncn2ccncc12 Amb25041465 [0,0,0,1,0,1|2,0,0]=4 2859 B15R2.73 CCOC(=O)c1nnc2ccccn12 Amb25735941 [0,0,0,1,0,1|2,0,0]=4 2860 B15R2.73 CCOC(=O)c1noc2ccccc12 Amb19889830 [0,0,0,1,0,1|1,0,0]=3 2861 B15R2.73 CCOC(=O)c1noc2ncccc12 Amb25851412 [0,0,0,1,0,1|2,0,0]=4 2862 B15R2.73 CCOC(=O)n1ccc2cccnc21 Amb27239110 [0,0,0,1,0,1|1,0,0]=3 2863 B15R2.73 CCOC(=O)n1nnc2ccccc21 Amb3432770 [0,0,0,1,0,1|2,0,0]=4 2864 B15R2.73 CCO\C(N)=C1/C=Nc2ccccc21 Amb26940281 [0,0,0,1,0,1|1,0,0]=3 2865 B15R2.73 CNCC(=O)c1coc2ccccc12 Amb30009593 [0,0,0,1,0,1|2,0,0]=4 2866 B15R2.73 CNCC(=O)c1csc2ccccc12 Amb33195462 [0,0,0,1,0,1|2,0,0]=4 2867 B15R2.73 CONC(=O)c1csc2ccccc12 Amb8224504 [0,0,0,1,0,1|2,0,0]=4 2868 B15R2.73 CSCC(=O)c1coc2ccccc12 Amb26958137 [0,0,0,1,0,1|2,0,0]=4 2869 B15R2.73 C\C=C\C(=O)c1coc2ccccc12 Amb30014002 [0,0,0,1,0,1|1,0,1]=4 2870 B15R2.73 C\C=C\C(=O)c1csc2ccccc12 Amb28435844 [0,0,0,1,0,1|1,0,1]=4 2871 B15R2.73 NCCC(=O)c1coc2ccccc12 Amb30009592 [0,0,0,1,0,1|2,0,0]=4 2872 B15R2.73 NCCC(=O)c1csc2ccccc12 Amb33195464 [0,0,0,1,0,1|2,0,0]=4 2873 B15R2.73 NCCC(=O)n1ccc2ccccc21 Amb27493160 [0,0,0,1,0,1|2,0,0]=4 2874 B15R2.73 O=C(CCCl)c1csc2ccccc12 Amb27814300 [0,0,0,1,0,1|2,0,0]=4 2875 B15R2.73 O=C(CCO)c1coc2ccccc12 Amb25699195 [0,0,0,1,0,1|2,0,0]=4 2876 B15R2.73 O=C(CCO)c1csc2ccccc12 Amb26383757 [0,0,0,1,0,1|2,0,0]=4 2877 B15R2.325 C[C@@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27970872 [0,0,0,1,0,1|0,0,2]=4 2878 B15R2.325 C[C@H]1OC(=O)N[C@@H]1Cc2ccccc2 Amb27841327 [0,0,0,1,0,1|0,0,2]=4 2879 B15R2.325 C[C@H]1OC(=O)N[C@H]1Cc2ccccc2 Amb27816387 [0,0,0,1,0,1|0,0,2]=4 2880 B15R2.325 O=C1C=C(Oc2ccccc2)C(=O)O1 Amb23556176 [0,0,0,1,0,1|1,0,1]=4 2881 B15R2.325 O=C1C\C(=C/c2ccccc2)C(=O)O1 Amb17470692 [0,0,0,1,0,1|1,0,1]=4 2882 B15R2.389 CC1CC(=O)NN=C1c2ccccc2 Amb28410017 [0,0,0,1,0,1|2,0,0]=4 2883 B15R2.389 CC1NC(=O)NC=C1c2ccccc2 Amb28422359 [0,0,0,1,0,1|1,0,0]=3 2884 B15R2.389 O=C1C=CC(c2ccccc2)=C(Cl)O1 Amb27958291 [0,0,0,1,0,1|1,0,1]=4 2885 B15R2.548 O=C1CCC(c2ccccc2)CCO1 Amb22337540 [0,0,0,1,0,1|0,0,2]=4 2886 B15R2.1342 CCOC(=O)C1CC1c2ccccc2 Amb2610679 [0,0,0,1,0,1|0,0,2]=4 2887 B15R2.1342 CCOC(=O)C1OC1c2ccccc2 Amb6356367 [0,0,0,1,0,1|0,0,2]=4 2888 B15R2.1342 CCOC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb10075604 [0,0,0,1,0,1|0,0,2]=4 2889 B15R2.1342 CCOC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb33523702 [0,0,0,1,0,1|0,0,2]=4 2890 B15R2.2196 C(=C\c1ccccc1)/CC2=NCCN2 Amb27434475 [0,0,0,1,0,1|2,0,0]=4 2891 B15R2.2196 C(=C\c1ccccc1)/NC2=NCCS2 Amb28067808 [0,0,0,1,0,1|1,1,0]=4 2892 B15R2.2349 CCN1C(=O)NC=C1c2ccccc2 Amb28249948 [0,0,0,1,0,1|1,0,0]=3 2893 B15R2.2349 CCn1c(-c2ccccc2)cnc1Cl Amb7093875 [0,0,0,1,0,1|2,0,0]=4 2894 B15R2.2349 CCn1c(-c2ccccc2)cnc1S Amb2319164 [0,0,0,1,0,1|1,1,0]=4 2895 B15R2.2349 CCn1c(-c2ccccc2)csc1=N Amb3673675 [0,0,0,1,0,1|2,0,0]=4 2896 B15R2.2349 CCn1c(C)ccc1-c2ccccc2 Amb17234204 [0,0,0,1,0,1|2,0,0]=4 2897 B15R2.2349 CCn1c(Cl)cnc1-c2ccccc2 Amb13881800 [0,0,0,1,0,1|2,0,0]=4 2898 B15R2.93174 CCOC(=O)NC1Cc2ccccc21 Amb28343266 [0,0,0,1,0,1|0,0,2]=4 2899 B15R2.27 CC1=CC(=O)C=C(c2ccccc2)N1 Amb22480153 [0,1,0,1,0,0|1,0,1]=4 2900 B15R2.27 CC1=CC(=O)C=C(c2ccccc2)O1 Amb21994249 [0,1,0,1,0,0|1,0,1]=4 2901 B15R2.27 CC1=CC(c2ccccc2)=CC(=O)O1 Amb20247497 [0,1,0,1,0,0|0,0,1]=3 2902 B15R2.27 CC1=NC(c2ccccc2)=CC(=O)N1 Amb18372453 [0,1,0,1,0,0|1,0,1]=4 2903 B15R2.27 CC1CC(=O)C=C(c2ccccc2)N1 Amb27642464 [0,1,0,1,0,0|1,0,0]=3 2904 B15R2.27 CC1C[C@@H](c2ccccc2)NC(=O)O1 Amb27387860 [0,1,0,1,0,0|1,0,1]=4 2905 B15R2.27 C[C@@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27978460 [0,1,0,1,0,0|1,0,1]=4 2906 B15R2.27 C[C@H]1C[C@@H](c2ccccc2)NC(=O)O1 Amb27623873 [0,1,0,1,0,0|1,0,1]=4 2907 B15R2.27 O=C1C=C(c2ccccc2)NC(=O)O1 Amb27827869 [0,1,0,1,0,0|1,0,1]=4 2908 B15R2.395 O=C1CCCC1C(=O)c2ccccc2 Amb6360858 [0,1,0,1,0,0|1,0,1]=4 2909 B15R2.395 O=C1CCCN1C(=O)c2ccccc2 Amb901969 [0,1,0,1,0,0|2,0,0]=4 2910 B15R2.395 O=C1NCCN1C(=O)c2ccccc2 Amb1645133 [0,1,0,1,0,0|2,0,0]=4 2911 B15R2.543 NC1=NCCNC(c2ccccc2)=C1 Amb4012649 [0,1,0,1,0,0|2,0,0]=4 2912 B15R2.543 O=C1C=C(c2ccccc2)CCCC1 Amb27853297 [0,1,0,1,0,0|1,0,0]=3 2913 B15R2.543 O=C1C=C(c2ccccc2)NCCC1 Amb27463117 [0,1,0,1,0,0|1,0,0]=3 2914 B15R2.543 O=C1C=C(c2ccccc2)NCCN1 Amb5720509 [0,1,0,1,0,0|1,0,0]=3 2915 B15R2.543 O=C1C=C(c2cccnc2)NCCN1 Amb33033076 [0,1,0,1,0,0|2,0,0]=4 2916 B15R2.543 O=C1CCCC=C(c2ccccc2)N1 Amb27602228 [0,1,0,1,0,0|2,0,0]=4 2917 B15R2.543 O=C1NOCCC(c2ccccc2)N1 Amb28040922 [0,1,0,1,0,0|1,0,1]=4 2918 B15R2.543 S=C1C=C(c2ccccc2)NCCN1 Amb27830049 [0,1,0,1,0,0|1,1,0]=4 2919 B15R2.886 CCCC1=CC(=O)c2ccccc2N1 Amb19046468 [0,1,0,1,0,0|2,0,0]=4 2920 B15R2.886 CCCc1cc(Cl)c2ccccc2n1 Amb9533773 [0,1,0,1,0,0|2,0,0]=4 2921 B15R2.886 CCCc1cc(N)c2ccccc2n1 Amb10240884 [0,1,0,1,0,0|2,0,0]=4 2922 B15R2.886 CCCc1cc(O)c2ccccc2n1 Amb9134494 [0,1,0,1,0,0|2,0,0]=4 2923 B15R2.886 CCNC1=CC(=O)c2ccccc2O1 Amb28408793 [0,1,0,1,0,0|1,0,1]=4 2924 B15R2.886 CCOC1=Cc2ccccc2C(=O)N1 Amb27827793 [0,1,0,1,0,0|2,0,0]=4 2925 B15R2.886 CCOC1=Nc2ccccc2C(=O)N1 Amb21948875 [0,1,0,1,0,0|2,0,0]=4 2926 B15R2.886 CCOC1=Nc2ccccc2C(=O)O1 Amb21927635 [0,1,0,1,0,0|2,0,0]=4 2927 B15R2.886 CCOc1cc(Br)c2ccccc2n1 Amb8438954 [0,1,0,1,0,0|1,0,0]=3 2928 B15R2.886 CCOc1cc(C)c2ccccc2c1 Amb28200879 [0,1,0,1,0,0|1,0,0]=3 2929 B15R2.886 CCOc1cc(Cl)c2ccccc2n1 Amb2615483 [0,1,0,1,0,0|1,0,0]=3 2930 B15R2.886 CCOc1cc(N)c2ccccc2n1 Amb18649921 [0,1,0,1,0,0|1,0,0]=3 2931 B15R2.886 CCOc1cc(N)c2ncccc2c1 Amb22899686 [0,1,0,1,0,0|2,0,0]=4 2932 B15R2.886 CCOc1cc(O)c2ccccc2n1 Amb18650121 [0,1,0,1,0,0|1,0,0]=3 2933 B15R2.886 CCOc1cc2ccccc2c(C)n1 Amb27983298 [0,1,0,1,0,0|2,0,0]=4 2934 B15R2.886 CCOc1nc(Cl)c2ccccc2n1 Amb28135820 [0,1,0,1,0,0|2,0,0]=4 2935 B15R2.886 CCSc1cc(C)c2ccccc2n1 Amb27491776 [0,1,0,1,0,0|1,1,0]=4 2936 B15R2.886 CCSc1cc(O)c2ccccc2c1 Amb28122351 [0,1,0,1,0,0|1,1,0]=4 2937 B15R2.1259 N\C(=C/C1=NCCO1)c2ccccc2 Amb27876009 [0,1,0,1,0,0|1,0,0]=3 2938 B15R2.1259 N\C(=C/C1=NCCO1)c2ccncc2 Amb27859089 [0,1,0,1,0,0|2,0,0]=4 2939 B15R2.1259 N\C(=C\C1=NCCO1)c2ccccc2 Amb27777189 [0,1,0,1,0,0|1,0,0]=3 2940 B15R2.1259 O=C(C=C1NCCN1)c2ccccc2 Amb2614173 [0,1,0,1,0,0|2,0,0]=4 2941 B15R2.1259 O=C(C=C1SCCS1)c2ccccc2 Amb21951869 [0,1,0,1,0,0|0,2,0]=4 2942 B15R2.1259 O=C(\C=C1/CCCO1)c2ccccc2 Amb2698448 [0,1,0,1,0,0|1,0,0]=3 2943 B15R2.1259 O=C(\C=C1/NCCS1)c2ccccc2 Amb24311851 [0,1,0,1,0,0|1,1,0]=4 2944 B15R2.1259 O=C(\C=C1\CCCO1)c2ccccc2 Amb25823730 [0,1,0,1,0,0|1,0,0]=3 2945 B15R2.1259 O=C(\C=C1\NCCO1)c2ccccn2 Amb27423150 [0,1,0,1,0,0|2,0,0]=4 2946 B15R2.1259 O=C(\C=C1\NCCS1)c2ccccc2 Amb27197577 [0,1,0,1,0,0|1,1,0]=4 2947 B15R2.2248 CCN1N=C(c2ccccc2)CC1=O Amb19059795 [0,1,0,1,0,0|1,0,1]=4 2948 B15R2.2248 CCn1nc(-c2ccccc2)cc1Br Amb32681948 [0,1,0,1,0,0|2,0,0]=4 2949 B15R2.2248 CCn1nc(-c2ccccc2)cc1N Amb18952958 [0,1,0,1,0,0|2,0,0]=4 2950 B15R2.2248 CCn1nc(-c2ccccc2)cc1O Amb27417780 [0,1,0,1,0,0|1,0,1]=4 2951 B15R2.6124 CCC1C(=O)NC(=O)c2ccccc21 Amb27463143 [0,1,0,1,0,0|2,0,0]=4 2952 B15R2.6124 CCC1C(=O)OC(=O)c2ccccc21 Amb23580672 [0,1,0,1,0,0|2,0,0]=4 2953 B15R2.6124 CCN1C(=O)C=C(Cl)c2ccccc21 Amb22463202 [0,1,0,1,0,0|1,0,0]=3 2954 B15R2.6124 CCN1C(=O)C=C(O)c2ccccc21 Amb19517249 [0,1,0,1,0,0|1,0,0]=3 2955 B15R2.6124 CCN1C(=O)N=C(N)c2ccccc21 Amb24506507 [0,1,0,1,0,0|2,0,0]=4 2956 B15R2.6124 CCN1C(=O)NC(=O)c2ccccc21 Amb19651650 [0,1,0,1,0,0|2,0,0]=4 2957 B15R2.6124 CCN1C(=O)OC(=O)c2ccccc21 Amb18533334 [0,1,0,1,0,0|2,0,0]=4 2958 B15R2.41154 O=C(CC(=O)C1CC1)c2ccccc2 Amb8832879 [0,1,0,1,0,0|1,0,1]=4 2959 B15R2.30 Nc1cccc(C2=CC(=O)CCC2)c1 Amb25266354 [0,1,0,1,0,0|1,0,0]=3 2960 B15R2.30 O=C1C=C(c2cccc(Br)c2)CCC1 Amb27882243 [0,1,0,1,0,0|1,0,0]=3 2961 B15R2.30 O=C1C=C(c2cccc(Br)c2)CN=N1 Amb27638233 [0,1,0,1,0,0|2,0,0]=4 2962 B15R2.30 O=C1C=C(c2cccc(O)c2)CCC1 Amb27599488 [0,1,0,1,0,0|1,0,0]=3 2963 B15R2.30 O=C1CC(c2cccc(Cl)c2)CCO1 Amb27632074 [0,1,0,1,0,0|0,0,2]=4 2964 B15R2.30 O=C1C[C@H](c2cccc(Cl)c2)CCO1 Amb27393669 [0,1,0,1,0,0|0,0,2]=4 2965 B15R2.30 O=C1NC(c2cccc(O)c2)CCO1 Amb28319620 [0,1,0,1,0,0|1,0,1]=4 2966 B15R2.30 O=C1N[C@H](c2cccc(Cl)c2)CCO1 Amb28044815 [0,1,0,1,0,0|1,0,1]=4 2967 B15R2.334 CC1=C(c2cccc(F)c2)NC(=O)O1 Amb27957601 [0,1,0,1,0,0|1,0,1]=4 2968 B15R2.334 C[C@@H]1OC(=O)N[C@@H]1c2cccc(O)c2 Amb27252366 [0,1,0,1,0,0|1,0,1]=4 2969 B15R2.334 C[C@H]1OC(=O)N[C@H]1c2cccc(I)c2 Amb28056031 [0,1,0,1,0,0|1,0,1]=4 2970 B15R2.334 Cc1cc(-c2cccc(N)c2)c(C)o1 Amb18945074 [0,1,0,1,0,0|1,0,1]=4 2971 B15R2.334 O=C1C=C(c2cccc(Br)c2)C(O)O1 Amb28383691 [0,1,0,1,0,0|1,0,0]=3 2972 B15R2.334 O=C1C=C(c2cccc(Cl)c2)C(=O)O1 Amb23441685 [0,1,0,1,0,0|1,0,1]=4 2973 B15R2.335 Nc1cccc(CN2CCOC2=O)c1 Amb6673415 [0,1,0,1,0,0|1,0,1]=4 2974 B15R2.335 Nc1cccc(\C=C2\CCCC2=O)c1 Amb28397952 [0,1,0,1,0,0|1,0,0]=3 2975 B15R2.335 Nc1cccc(\C=C2\CCOC2=O)c1 Amb27386692 [0,1,0,1,0,0|0,0,0]=2 2976 B15R2.335 O=C1CCC\C1=C\c2cccc(O)c2 Amb28132444 [0,1,0,1,0,0|1,0,0]=3 2977 B15R2.335 O=C1OCCC1Cc2cccc(O)c2 Amb27750325 [0,1,0,1,0,0|0,0,2]=4 2978 B15R2.335 O=C1OCCC1Nc2cccc(F)c2 Amb26644065 [0,1,0,1,0,0|1,0,1]=4 2979 B15R2.335 O=C1OCCC1Sc2cccc(O)c2 Amb28045383 [0,1,0,1,0,0|1,0,1]=4 2980 B15R2.335 O=C1OCC\C1=C\c2cccc(O)c2 Amb28411261 [0,1,0,1,0,0|0,0,0]=2 2981 B15R2.1290 CCCc1ccc2cccc(S)c2n1 Amb27441551 [0,1,0,1,0,0|2,0,0]=4 2982 B15R2.1290 CCNc1ccc2cccc(F)c2n1 Amb27805668 [0,1,0,1,0,0|2,0,0]=4 2983 B15R2.1290 CCOc1ccc2c(c1)C(=O)C=CN2 Amb19047360 [0,1,0,1,0,0|2,0,0]=4 2984 B15R2.1290 CCOc1ccc2c(c1)C(=O)NC=C2 Amb24446932 [0,1,0,1,0,0|2,0,0]=4 2985 B15R2.1290 CCOc1ccc2c(c1)C(=S)C=CN2 Amb24111607 [0,1,0,1,0,0|2,0,0]=4 2986 B15R2.1290 CCOc1ccc2cccc(C)c2n1 Amb20171156 [0,1,0,1,0,0|1,0,0]=3 2987 B15R2.1290 CCOc1ccc2cccc(N)c2c1 Amb26494956 [0,1,0,1,0,0|1,0,0]=3 2988 B15R2.1290 CCOc1ccc2cccc(O)c2c1 Amb35745231 [0,1,0,1,0,0|1,0,0]=3 2989 B15R2.1290 CCOc1ccc2cccc(O)c2n1 Amb28123735 [0,1,0,1,0,0|1,0,0]=3 2990 B15R2.1290 CCOc1ccc2ccnc(Br)c2c1 Amb32684073 [0,1,0,1,0,0|2,0,0]=4 2991 B15R2.1290 CCOc1ccc2ccnc(Cl)c2c1 Amb27882459 [0,1,0,1,0,0|2,0,0]=4 2992 B15R2.1290 CCOc1ccc2cncc(Br)c2c1 Amb28251453 [0,1,0,1,0,0|2,0,0]=4 2993 B15R2.1290 CCOc1ccc2nccc(C)c2c1 Amb18354497 [0,1,0,1,0,0|2,0,0]=4 2994 B15R2.1290 CCOc1ccc2nccc(Cl)c2c1 Amb1994631 [0,1,0,1,0,0|2,0,0]=4 2995 B15R2.1290 CCOc1ccc2nccc(Cl)c2n1 Amb22490619 [0,1,0,1,0,0|2,0,0]=4 2996 B15R2.1290 CCOc1ccc2nccc(N)c2c1 Amb1994595 [0,1,0,1,0,0|2,0,0]=4 2997 B15R2.1290 CCOc1ccc2nccc(O)c2c1 Amb1994852 [0,1,0,1,0,0|2,0,0]=4 2998 B15R2.5773 CCN1C(=O)C=Cc2cc(N)ccc21 Amb27407797 [0,1,0,1,0,0|1,0,0]=3 2999 B15R2.5773 CC[n+]1c(C)ccc2cc(C)ccc21 Amb2716210 [0,1,0,1,0,0|2,0,0]=4 3000 B15R2.5773 CCc1c(O)ccc2cc(C)ccc12 Amb28365143 [0,1,0,1,0,0|1,0,1]=4 3001 B15R2.10252 CCCc1ccc2cc(Br)ccc2n1 Amb8388526 [0,1,0,1,0,0|2,0,0]=4 3002 B15R2.10252 CCCc1ccc2cc(N)ccc2c1 Amb28066680 [0,1,0,1,0,0|2,0,0]=4 3003 B15R2.10252 CCCc1ccc2cc(O)ccc2c1 Amb2721343 [0,1,0,1,0,0|2,0,0]=4 3004 B15R2.10252 CCNc1ccc2cc(Br)ccc2c1 Amb27223771 [0,1,0,1,0,0|2,0,0]=4 3005 B15R2.10252 CCNc1ccc2cc(F)ccc2n1 Amb27804386 [0,1,0,1,0,0|2,0,0]=4 3006 B15R2.10252 CCNc1ccc2cc(I)ccc2n1 Amb27594263 [0,1,0,1,0,0|2,0,0]=4 3007 B15R2.10252 CCNc1ccc2cc(N)ccc2n1 Amb9310171 [0,1,0,1,0,0|2,0,0]=4 3008 B15R2.10252 CCOc1ccc2c(c1)C=CC(=O)N2 Amb18546024 [0,1,0,1,0,0|2,0,0]=4 3009 B15R2.10252 CCOc1ccc2c(c1)C=CC(=O)O2 Amb27847274 [0,1,0,1,0,0|2,0,0]=4 3010 B15R2.10252 CCOc1ccc2cc(Br)ccc2c1 Amb1482232 [0,1,0,1,0,0|1,0,0]=3 3011 B15R2.10252 CCOc1ccc2cc(Br)ccc2n1 Amb25705255 [0,1,0,1,0,0|1,0,0]=3 3012 B15R2.10252 CCOc1ccc2cc(Br)cnc2c1 Amb24637031 [0,1,0,1,0,0|2,0,0]=4 3013 B15R2.10252 CCOc1ccc2cc(C)ccc2c1 Amb26873310 [0,1,0,1,0,0|1,0,0]=3 3014 B15R2.10252 CCOc1ccc2cc(Cl)ccc2c1 Amb27450094 [0,1,0,1,0,0|1,0,0]=3 3015 B15R2.10252 CCOc1ccc2cc(N)ccc2c1 Amb10070900 [0,1,0,1,0,0|1,0,0]=3 3016 B15R2.10252 CCOc1ccc2cc(N)cnc2c1 Amb23580255 [0,1,0,1,0,0|2,0,0]=4 3017 B15R2.10252 CCOc1ccc2cc(O)ccc2c1 Amb27611869 [0,1,0,1,0,0|1,0,0]=3 3018 B15R2.10252 CCOc1ccc2cc(O)ncc2c1 Amb27603685 [0,1,0,1,0,0|2,0,0]=4 3019 B15R2.10252 CCOc1ccc2cc(S)ccc2c1 Amb27182015 [0,1,0,1,0,0|1,0,0]=3 3020 B15R2.10252 CCOc1ccc2nc(Br)ccc2c1 Amb27166226 [0,1,0,1,0,0|2,0,0]=4 3021 B15R2.10252 CCOc1ccc2nc(C)ccc2c1 Amb4035127 [0,1,0,1,0,0|2,0,0]=4 3022 B15R2.10252 CCOc1ccc2nc(Cl)ccc2c1 Amb23449334 [0,1,0,1,0,0|2,0,0]=4 3023 B15R2.10252 CCOc1ccc2nc(N)ccc2c1 Amb24474585 [0,1,0,1,0,0|2,0,0]=4 3024 B15R2.10252 CCOc1ccc2nc(S)ccc2c1 Amb26876637 [0,1,0,1,0,0|2,0,0]=4 3025 B15R2.10252 CCOc1cnc2cc(F)ccc2n1 Amb27463519 [0,1,0,1,0,0|2,0,0]=4 3026 B15R2.10252 CCOc1cnc2cc(N)ccc2n1 Amb28135716 [0,1,0,1,0,0|2,0,0]=4 3027 B15R2.36351 CCN1C(=O)C=Cc2cccc(N)c21 Amb25080048 [0,1,0,1,0,0|1,0,0]=3 3028 B15R2.75291 CCOC(=O)C1Cc2cccc(N)c21 Amb26554455 [0,1,0,1,0,0|0,0,2]=4 3029 B15R2.32 NC1=C(c2ccccc2)CCCC1=O Amb27758644 [0,1,0,1,0,0|1,0,0]=3 3030 B15R2.32 O=C1CCCC(c2ccccc2)=C1O Amb8394182 [0,1,0,1,0,0|1,0,0]=3 3031 B15R2.32 O=C1OCC=C(c2ccccc2)C1O Amb28455649 [0,1,0,1,0,0|0,0,2]=4 3032 B15R2.32 O=C1OCCN(c2ccccc2)C1=O Amb10064379 [0,1,0,1,0,0|1,0,0]=3 3033 B15R2.38 O=C1C=CCC\C1=C/c2ccccc2 Amb2386555 [0,1,0,1,0,0|1,0,0]=3 3034 B15R2.38 O=C1CCCC\C1=C/c2ccccc2 Amb33513197 [0,1,0,1,0,0|1,0,0]=3 3035 B15R2.38 O=C1CCCC\C1=C/c2cccnc2 Amb24598643 [0,1,0,1,0,0|2,0,0]=4 3036 B15R2.38 O=C1CCCC\C1=C/c2ccncc2 Amb1486636 [0,1,0,1,0,0|2,0,0]=4 3037 B15R2.38 O=C1COCCC1Cc2ccccc2 Amb33482649 [0,1,0,1,0,0|0,0,2]=4 3038 B15R2.38 O=C1COCCN1Cc2ccccc2 Amb19943958 [0,1,0,1,0,0|1,0,1]=4 3039 B15R2.38 O=C1NCCC\C1=C/c2ccccc2 Amb8439773 [0,1,0,1,0,0|1,0,0]=3 3040 B15R2.38 O=C1OCCC=C1Sc2ccccc2 Amb27470101 [0,1,0,1,0,0|1,0,0]=3 3041 B15R2.38 O=C1OCCN=C1Nc2ccccc2 Amb27876401 [0,1,0,1,0,0|1,0,0]=3 3042 B15R2.64 C\C(=C/c1ccccc1)C2OCCO2 Amb27175335 [0,1,0,1,0,0|0,0,2]=4 3043 B15R2.64 O=C(Nc1ccccc1)C2=CCCO2 Amb28408891 [0,1,0,1,0,0|2,0,0]=4 3044 B15R2.212 O=C1C(=O)C(c2ccccc2)=C1CO Amb27766633 [0,1,0,1,0,0|2,0,0]=4 3045 B15R2.323 C=C1C(=O)NC(C)C1c2ccccc2 Amb27234691 [0,1,0,1,0,0|1,0,1]=4 3046 B15R2.323 CC1=C(c2ccccc2)C(C)NC1=O Amb27619220 [0,1,0,1,0,0|1,0,0]=3 3047 B15R2.405 NC1(Cc2ccccc2)CCOC1=O Amb18650819 [0,1,0,1,0,0|0,0,2]=4 3048 B15R2.405 O=C1OCCC1(O)Cc2ccccc2 Amb27478706 [0,1,0,1,0,0|0,0,2]=4 3049 B15R2.888 CCCc1cc2ccccc2cc1Br Amb32650450 [0,1,0,1,0,0|2,0,0]=4 3050 B15R2.888 CCCc1cc2ccccc2cc1Cl Amb32650451 [0,1,0,1,0,0|2,0,0]=4 3051 B15R2.888 CCCc1cc2ccccc2cc1O Amb27612777 [0,1,0,1,0,0|2,0,0]=4 3052 B15R2.888 CCCc1nc2ccccc2cc1O Amb33133842 [0,1,0,1,0,0|2,0,0]=4 3053 B15R2.888 CCOC1=Nc2ccccc2NC1=O Amb19651674 [0,1,0,1,0,0|2,0,0]=4 3054 B15R2.888 CCOc1cc2ccccc2cc1Cl Amb27816650 [0,1,0,1,0,0|1,0,0]=3 3055 B15R2.888 CCOc1cc2cccnc2cc1Br Amb23437332 [0,1,0,1,0,0|2,0,0]=4 3056 B15R2.888 CCOc1nc2ccccc2nc1C Amb591495 [0,1,0,1,0,0|2,0,0]=4 3057 B15R2.888 CCOc1nc2ccccc2nc1Cl Amb20618617 [0,1,0,1,0,0|2,0,0]=4 3058 B15R2.888 CCOc1nc2ccccc2nc1F Amb35593851 [0,1,0,1,0,0|2,0,0]=4 3059 B15R2.888 CCOc1nc2cccnc2cc1N Amb18650177 [0,1,0,1,0,0|2,0,0]=4 3060 B15R2.888 CCOc1nc2ncccc2cc1N Amb32424341 [0,1,0,1,0,0|2,0,0]=4 3061 B15R2.1356 CCCC(=O)c1cc2ccccc2o1 Amb19046924 [0,1,0,1,0,0|1,0,0]=3 3062 B15R2.1356 CCNC(=N)c1cc2ccccc2o1 Amb27661283 [0,1,0,1,0,0|2,0,0]=4 3063 B15R2.1356 CCNC(=O)c1cc2ccccc2o1 Amb661322 [0,1,0,1,0,0|1,0,0]=3 3064 B15R2.1356 CCNC(=O)c1cn2ccccc2n1 Amb8330928 [0,1,0,1,0,0|2,0,0]=4 3065 B15R2.1356 CCNC(=O)c1nc2ccccc2s1 Amb27832639 [0,1,0,1,0,0|2,0,0]=4 3066 B15R2.1356 CCOC(=O)C1=CC2C=CC=CC2=C1 Amb9678006 [0,1,0,1,0,0|0,0,1]=3 3067 B15R2.1356 CCOC(=O)C1=CN2C=CC=CC2N1 Amb25726897 [0,1,0,1,0,0|1,0,1]=4 3068 B15R2.1356 CCOC(=O)C1=Cc2ccccc2C1 Amb28410066 [0,1,0,1,0,0|0,0,0]=2 3069 B15R2.1356 CCOC(=O)C1Cc2ccccc2N1 Amb8393476 [0,1,0,1,0,0|0,0,2]=4 3070 B15R2.1356 CCOC(=O)N1Cc2ccccc2C1 Amb27478231 [0,1,0,1,0,0|1,0,1]=4 3071 B15R2.1356 CCOC(=O)[C@@H]1Cc2ccccc2N1 Amb8393782 [0,1,0,1,0,0|0,0,2]=4 3072 B15R2.1356 CCOC(=O)[C@@H]1Cc2ccccc2N1 Amb8631215 [0,1,0,1,0,0|0,0,2]=4 3073 B15R2.1356 CCOC(=O)[C@H]1Cc2ccccc2N1 Amb27956885 [0,1,0,1,0,0|0,0,2]=4 3074 B15R2.1356 CCOC(=O)c1cc2ccccc2o1 Amb5492722 [0,1,0,1,0,0|0,0,0]=2 3075 B15R2.1356 CCOC(=O)c1cc2ccccc2s1 Amb9828278 [0,1,0,1,0,0|0,0,0]=2 3076 B15R2.1356 CCOC(=O)c1cc2ccccn2c1 Amb24646842 [0,1,0,1,0,0|1,0,0]=3 3077 B15R2.1356 CCOC(=O)c1cc2cccnc2s1 Amb2723083 [0,1,0,1,0,0|1,0,0]=3 3078 B15R2.1356 CCOC(=O)c1cc2cccnn2c1 Amb26559969 [0,1,0,1,0,0|2,0,0]=4 3079 B15R2.1356 CCOC(=O)c1cc2cccnn2n1 Amb25853599 [0,1,0,1,0,0|2,0,0]=4 3080 B15R2.1356 CCOC(=O)c1cc2ccncc2o1 Amb21961280 [0,1,0,1,0,0|1,0,0]=3 3081 B15R2.1356 CCOC(=O)c1cc2ccncc2s1 Amb24367158 [0,1,0,1,0,0|1,0,0]=3 3082 B15R2.1356 CCOC(=O)c1cc2ncccc2o1 Amb26361418 [0,1,0,1,0,0|1,0,0]=3 3083 B15R2.1356 CCOC(=O)c1cc2ncccc2s1 Amb26349280 [0,1,0,1,0,0|1,0,0]=3 3084 B15R2.1356 CCOC(=O)c1cc2ncccn2n1 Amb22494680 [0,1,0,1,0,0|2,0,0]=4 3085 B15R2.1356 CCOC(=O)c1cc2nccnc2s1 Amb22370973 [0,1,0,1,0,0|2,0,0]=4 3086 B15R2.1356 CCOC(=O)c1cn2ccccc2n1 Amb1107147 [0,1,0,1,0,0|1,0,0]=3 3087 B15R2.1356 CCOC(=O)c1cn2ccccc2n1 Amb17602733 [0,1,0,1,0,0|1,0,0]=3 3088 B15R2.1356 CCOC(=O)c1cn2ccccc2n1 Amb33339186 [0,1,0,1,0,0|1,0,0]=3 3089 B15R2.1356 CCOC(=O)c1cn2cccnc2n1 Amb2235933 [0,1,0,1,0,0|2,0,0]=4 3090 B15R2.1356 CCOC(=O)c1cn2ccncc2n1 Amb13883557 [0,1,0,1,0,0|2,0,0]=4 3091 B15R2.1356 CCOC(=O)c1cn2cnccc2n1 Amb27453353 [0,1,0,1,0,0|2,0,0]=4 3092 B15R2.1356 CCOC(=O)c1cn2ncccc2n1 Amb22886620 [0,1,0,1,0,0|2,0,0]=4 3093 B15R2.1356 CCOC(=O)c1nc2ccccc2o1 Amb21858236 [0,1,0,1,0,0|1,0,0]=3 3094 B15R2.1356 CCOC(=O)c1nc2ccccc2s1 Amb6323614 [0,1,0,1,0,0|1,0,0]=3 3095 B15R2.1356 CCOC(=O)c1nc2ccccn2n1 Amb22263753 [0,1,0,1,0,0|2,0,0]=4 3096 B15R2.1356 CCOC(=O)c1nc2cccnc2s1 Amb33547943 [0,1,0,1,0,0|2,0,0]=4 3097 B15R2.1356 CCOC(=O)c1nc2ccncc2s1 Amb22749275 [0,1,0,1,0,0|2,0,0]=4 3098 B15R2.1356 CCOC(=O)c1nc2cnccc2o1 Amb27963149 [0,1,0,1,0,0|2,0,0]=4 3099 B15R2.1356 CCOC(=O)c1nc2cnccc2s1 Amb24453499 [0,1,0,1,0,0|2,0,0]=4 3100 B15R2.1356 CCOC(=O)c1nc2ncccc2o1 Amb22234766 [0,1,0,1,0,0|2,0,0]=4 3101 B15R2.1356 CCOC(=O)c1nc2ncccc2s1 Amb26844165 [0,1,0,1,0,0|2,0,0]=4 3102 B15R2.1356 CCSC(=O)c1nc2ccccc2o1 Amb27962956 [0,1,0,1,0,0|1,1,0]=4 3103 B15R2.1356 CNCC(=O)c1cc2ccccc2s1 Amb33314053 [0,1,0,1,0,0|2,0,0]=4 3104 B15R2.1356 COCC(=O)c1cc2ccccc2o1 Amb9665978 [0,1,0,1,0,0|2,0,0]=4 3105 B15R2.1356 COCC(=O)c1cc2ccccc2s1 Amb28136328 [0,1,0,1,0,0|2,0,0]=4 3106 B15R2.1356 CSCC(=O)c1cc2ccccc2o1 Amb26341693 [0,1,0,1,0,0|2,0,0]=4 3107 B15R2.1356 C\C=C\C(=O)c1cc2ccccc2o1 Amb27183552 [0,1,0,1,0,0|1,0,1]=4 3108 B15R2.1356 NCCC(=O)c1cc2ccccc2o1 Amb18559435 [0,1,0,1,0,0|2,0,0]=4 3109 B15R2.1356 NCCC(=O)c1cc2ccccc2s1 Amb18782491 [0,1,0,1,0,0|2,0,0]=4 3110 B15R2.1356 O=C(CCCl)c1cc2ccccc2o1 Amb28190929 [0,1,0,1,0,0|2,0,0]=4 3111 B15R2.1356 O=C(NCCl)c1cc2ccccc2o1 Amb2867119 [0,1,0,1,0,0|2,0,0]=4 3112 B15R2.6237 CCN1C(=O)C(C)=Nc2ccccc21 Amb27243869 [0,1,0,1,0,0|2,0,0]=4 3113 B15R2.6237 CCN1C(=O)C(Cl)=Nc2ccccc21 Amb26969030 [0,1,0,1,0,0|2,0,0]=4 3114 B15R2.6237 CCN1C(=O)C(N)=Cc2ccccc21 Amb22372129 [0,1,0,1,0,0|1,0,0]=3 3115 B15R2.6237 CCN1C(=O)C(O)=Cc2ccccc21 Amb27491616 [0,1,0,1,0,0|1,0,0]=3 3116 B15R2.6237 CCN1C(=O)C(O)=Nc2ccccc21 Amb19651675 [0,1,0,1,0,0|2,0,0]=4 3117 B15R2.6237 CCc1c(C)c(O)cc2ccccc12 Amb27828809 [0,1,0,1,0,0|2,0,0]=4 3118 B15R2.6237 CON1C(=O)C(N)=Cc2ccccc21 Amb27870418 [0,1,0,1,0,0|2,0,0]=4 3119 B15R2.16 CCC1=C(c2ccccc2)NC(=N)O1 Amb33548375 [0,1,0,1,0,0|2,0,0]=4 3120 B15R2.16 CCC1=C(c2ccccc2)NC(=O)S1 Amb19372954 [0,1,0,1,0,0|1,1,0]=4 3121 B15R2.16 CCC1=C(c2ccccn2)NC(=O)O1 Amb28121872 [0,1,0,1,0,0|2,0,0]=4 3122 B15R2.16 CCc1oc(Br)nc1-c2ccccc2 Amb28369201 [0,1,0,1,0,0|2,0,0]=4 3123 B15R2.16 CCc1oc(N)nc1-c2ccccc2 Amb6360465 [0,1,0,1,0,0|2,0,0]=4 3124 B15R2.16 CO[C@@H]1OC(=O)N[C@H]1c2ccccc2 Amb27221136 [0,1,0,1,0,0|1,0,1]=4 3125 B15R2.16 NCC1=C(c2ccccc2)OC(=O)O1 Amb33297549 [0,1,0,1,0,0|1,0,1]=4 3126 B15R2.16 NC[C@@H]1OC(=O)N[C@H]1c2ccccc2 Amb27880655 [0,1,0,1,0,0|1,0,1]=4 3127 B15R2.16 O=C1C=C(c2ccccc2)\C(=C\F)O1 Amb22497562 [0,1,0,1,0,0|0,0,2]=4 3128 B15R2.16 O=C1C[C@@H](c2ccccc2)[C@H](CO)O1 Amb27977898 [0,1,0,1,0,0|0,0,2]=4 3129 B15R2.16 O=C1OC(CBr)=C(c2ccccc2)O1 Amb27947546 [0,1,0,1,0,0|1,0,1]=4 3130 B15R2.16 O=C1OC(CCl)=C(c2ccccc2)O1 Amb27488592 [0,1,0,1,0,0|1,0,1]=4 3131 B15R2.16 O=C1OC(CO)=C(c2ccccc2)O1 Amb27858283 [0,1,0,1,0,0|1,0,1]=4 3132 B15R2.16 O=C1O[C@@H](CO)[C@H](c2ccccc2)O1 Amb27218638 [0,1,0,1,0,0|1,0,1]=4 3133 B15R2.33 CC1CCC(=O)C=C1c2ccccc2 Amb2226908 [0,1,0,1,0,0|1,0,0]=3 3134 B15R2.33 C[C@@H]1COC(=O)N[C@@H]1c2ccccc2 Amb28246373 [0,1,0,1,0,0|1,0,1]=4 3135 B15R2.33 NC1CCC(=O)C=C1c2ccccc2 Amb27842433 [0,1,0,1,0,0|1,0,0]=3 3136 B15R2.33 N[C@H]1COC(=O)C[C@@H]1c2ccccc2 Amb27790730 [0,1,0,1,0,0|0,0,2]=4 3137 B15R2.33 O=C1OCC(Cl)[C@H](c2ccccc2)O1 Amb27169459 [0,1,0,1,0,0|1,0,1]=4 3138 B15R2.283 CC1NC(\C=C\c2ccccc2)=NO1 Amb27230207 [0,1,0,1,0,0|1,0,0]=3 3139 B15R2.283 OC1CCC(\C=C\c2ccccc2)O1 Amb22752563 [0,1,0,1,0,0|1,0,1]=4 3140 B15R2.352 BrCCCc1ccc2ccccc2c1 Amb26339538 [0,1,0,1,0,0|2,0,0]=4 3141 B15R2.352 BrCCCc1ccc2ccccc2n1 Amb33038200 [0,1,0,1,0,0|2,0,0]=4 3142 B15R2.352 BrCCOc1ccc2ccccc2c1 Amb2610625 [0,1,0,1,0,0|1,0,0]=3 3143 B15R2.352 BrCCOc1ccc2ccncc2c1 Amb24410986 [0,1,0,1,0,0|2,0,0]=4 3144 B15R2.352 BrCCOc1ccc2ncccc2c1 Amb17262598 [0,1,0,1,0,0|2,0,0]=4 3145 B15R2.352 BrCCSc1ccc2ccccc2n1 Amb27824842 [0,1,0,1,0,0|1,1,0]=4 3146 B15R2.352 C#CCOc1ccc2ccccc2c1 Amb3836118 [0,1,0,1,0,0|1,0,1]=4 3147 B15R2.352 C=CCOc1ccc2ccccc2c1 Amb3836124 [0,1,0,1,0,0|1,0,1]=4 3148 B15R2.352 CCCCc1ccc2ccccc2c1 Amb9787702 [0,1,0,1,0,0|2,0,0]=4 3149 B15R2.352 CCCCc1ccc2ccccc2n1 Amb4012109 [0,1,0,1,0,0|2,0,0]=4 3150 B15R2.352 CCCOc1ccc2ccccc2c1 Amb4011084 [0,1,0,1,0,0|1,0,0]=3 3151 B15R2.352 CCCOc1ccc2ccccc2n1 Amb20171237 [0,1,0,1,0,0|1,0,0]=3 3152 B15R2.352 CCNCc1ccc2ccccc2c1 Amb6266033 [0,1,0,1,0,0|2,0,0]=4 3153 B15R2.352 CCNCc1ccc2ccccc2n1 Amb19373560 [0,1,0,1,0,0|2,0,0]=4 3154 B15R2.352 CCNCc1ccc2ccccc2n1 Amb6742542 [0,1,0,1,0,0|2,0,0]=4 3155 B15R2.352 CCNSc1ccc2ccccc2n1 Amb27854234 [0,1,0,1,0,0|1,1,0]=4 3156 B15R2.352 CCOCc1cc2ccccc2cn1 Amb28436269 [0,1,0,1,0,0|2,0,0]=4 3157 B15R2.352 CCOCc1cnc2ccccc2n1 Amb27843681 [0,1,0,1,0,0|2,0,0]=4 3158 B15R2.352 CNCCc1ccc2ccccc2c1 Amb8853663 [0,1,0,1,0,0|2,0,0]=4 3159 B15R2.352 CNCCc1ccc2ccccc2n1 Amb18299521 [0,1,0,1,0,0|2,0,0]=4 3160 B15R2.352 CNCCc1ccc2ccccc2n1 Amb32671506 [0,1,0,1,0,0|2,0,0]=4 3161 B15R2.352 COCOc1ccc2ccccc2n1 Amb28066084 [0,1,0,1,0,0|1,0,0]=3 3162 B15R2.352 ClCCCc1ccc2ccccc2c1 Amb27181357 [0,1,0,1,0,0|2,0,0]=4 3163 B15R2.352 ClCCCc1ccc2ccccc2n1 Amb28293470 [0,1,0,1,0,0|2,0,0]=4 3164 B15R2.352 ClCCNc1ccc2ccccc2n1 Amb27247812 [0,1,0,1,0,0|2,0,0]=4 3165 B15R2.352 ClCCOc1ccc2ccccc2c1 Amb8828442 [0,1,0,1,0,0|1,0,0]=3 3166 B15R2.352 ClCCOc1ccc2ncccc2c1 Amb17239671 [0,1,0,1,0,0|2,0,0]=4 3167 B15R2.352 ClCCSc1ccc2ccccc2c1 Amb9250177 [0,1,0,1,0,0|1,1,0]=4 3168 B15R2.352 FCCNc1ccc2ccccc2n1 Amb27251247 [0,1,0,1,0,0|2,0,0]=4 3169 B15R2.352 FCCOc1ccc2ccccc2c1 Amb24562684 [0,1,0,1,0,0|1,0,0]=3 3170 B15R2.352 ICCOc1ccc2ccccc2c1 Amb28454505 [0,1,0,1,0,0|1,0,0]=3 3171 B15R2.352 N#CCOc1ccc2ccccc2c1 Amb1395353 [0,1,0,1,0,0|1,0,1]=4 3172 B15R2.352 NCCCc1ccc2ccccc2c1 Amb18981387 [0,1,0,1,0,0|2,0,0]=4 3173 B15R2.352 NCCCc1ccc2ccccc2n1 Amb17578461 [0,1,0,1,0,0|2,0,0]=4 3174 B15R2.352 NCCNc1ccc2ccccc2c1 Amb18992219 [0,1,0,1,0,0|2,0,0]=4 3175 B15R2.352 NCCNc1ccc2ccccc2n1 Amb33526502 [0,1,0,1,0,0|2,0,0]=4 3176 B15R2.352 NCCNc1ccc2ccccc2n1 Amb33552829 [0,1,0,1,0,0|2,0,0]=4 3177 B15R2.352 NCCOc1ccc2ccccc2c1 Amb1069042 [0,1,0,1,0,0|1,0,0]=3 3178 B15R2.352 NCCOc1ccc2ccccc2c1 Amb6859385 [0,1,0,1,0,0|1,0,0]=3 3179 B15R2.352 NCCOc1ccc2ccccc2n1 Amb18296487 [0,1,0,1,0,0|1,0,0]=3 3180 B15R2.352 NCCOc1ccc2cccnc2c1 Amb19107899 [0,1,0,1,0,0|2,0,0]=4 3181 B15R2.352 NCCOc1ccc2ccncc2c1 Amb18355016 [0,1,0,1,0,0|2,0,0]=4 3182 B15R2.352 NCCOc1ccc2ncccc2c1 Amb19107900 [0,1,0,1,0,0|2,0,0]=4 3183 B15R2.352 NCCOc1ccc2ncccc2c1 Amb32662376 [0,1,0,1,0,0|2,0,0]=4 3184 B15R2.352 NCCOc1cnc2ccccc2c1 Amb25701399 [0,1,0,1,0,0|2,0,0]=4 3185 B15R2.352 NCCOc1cnc2ccccc2n1 Amb18297203 [0,1,0,1,0,0|2,0,0]=4 3186 B15R2.352 O=CCOc1ccc2ccccc2c1 Amb5731849 [0,1,0,1,0,0|1,0,1]=4 3187 B15R2.352 OCCCc1ccc2ccccc2c1 Amb24401038 [0,1,0,1,0,0|2,0,0]=4 3188 B15R2.352 OCCCc1ccc2ccccc2n1 Amb20669490 [0,1,0,1,0,0|2,0,0]=4 3189 B15R2.352 OCCNc1ccc2ccccc2n1 Amb2618112 [0,1,0,1,0,0|2,0,0]=4 3190 B15R2.352 OCCOc1ccc2ccccc2c1 Amb4034898 [0,1,0,1,0,0|1,0,0]=3 3191 B15R2.352 OCCOc1ccc2ccccc2n1 Amb27981845 [0,1,0,1,0,0|1,0,0]=3 3192 B15R2.352 OCCOc1ccc2ccncc2c1 Amb26891029 [0,1,0,1,0,0|2,0,0]=4 3193 B15R2.352 OCCOc1ccc2ncccc2c1 Amb17105029 [0,1,0,1,0,0|2,0,0]=4 3194 B15R2.352 OCCOc1cnc2ccccc2n1 Amb2445501 [0,1,0,1,0,0|2,0,0]=4 3195 B15R2.352 SCCCc1ccc2ccccc2c1 Amb31132725 [0,1,0,1,0,0|2,0,0]=4 3196 B15R2.352 SCCCc1ccc2ccccc2n1 Amb33201029 [0,1,0,1,0,0|2,0,0]=4 3197 B15R2.352 SCCOc1ccc2ccccc2c1 Amb17238164 [0,1,0,1,0,0|1,0,0]=3 3198 B15R2.352 SCCOc1ccc2cccnc2c1 Amb27824036 [0,1,0,1,0,0|2,0,0]=4 3199 B15R2.352 SCCOc1ccc2ncccc2c1 Amb17238467 [0,1,0,1,0,0|2,0,0]=4 3200 B15R2.355 CC1=C(Cc2ccccc2)C(=O)CC1 Amb26329510 [0,1,0,1,0,0|1,0,1]=4 3201 B15R2.355 CC1=NOC(=O)\C1=C/c2ccccc2 Amb2228119 [0,1,0,1,0,0|0,0,1]=3 3202 B15R2.355 CC1OCC(=O)C1Cc2ccccc2 Amb35683067 [0,1,0,1,0,0|0,0,2]=4 3203 B15R2.355 NC1COC(=O)C1Cc2ccccc2 Amb27640196 [0,1,0,1,0,0|0,0,2]=4 3204 B15R2.355 N[C@H]1COC(=O)[C@@H]1Cc2ccccc2 Amb28252308 [0,1,0,1,0,0|0,0,2]=4 3205 B15R2.355 O=C1CNC(=O)\C1=C/c2ccccc2 Amb588831 [0,1,0,1,0,0|1,0,1]=4 3206 B15R2.355 O=C1OCC(O)=C1Cc2ccccc2 Amb4011620 [0,1,0,1,0,0|0,0,2]=4 3207 B15R2.355 O=C1OCC(O)C1Cc2ccccc2 Amb27662267 [0,1,0,1,0,0|0,0,2]=4 3208 B15R2.355 O=C1OC[C@@H](O)[C@@H]1Cc2ccccc2 Amb28287695 [0,1,0,1,0,0|0,0,2]=4 3209 B15R2.355 O=C1OC[C@@H](O)[C@H]1Cc2ccccc2 Amb28079119 [0,1,0,1,0,0|0,0,2]=4 3210 B15R2.355 O=C1OC[C@H](O)[C@H]1Cc2ccccc2 Amb28079150 [0,1,0,1,0,0|0,0,2]=4 3211 B15R2.505 CC1OC1C(=O)OCc2ccccc2 Amb25801937 [0,1,0,1,0,0|1,0,1]=4 3212 B15R2.505 C[C@@H]1O[C@@H]1C(=O)NCc2ccccc2 Amb28133421 [0,1,0,1,0,0|1,0,1]=4 3213 B15R2.505 C[C@@H]1O[C@H]1[C@@H](O)\C=C\c2ccccc2 Amb27196789 [0,1,0,1,0,0|0,0,2]=4 3214 B15R2.2195 C(=C\C1CNCCO1)/c2ccccc2 Amb33083004 [0,1,0,1,0,0|1,0,1]=4 3215 B15R2.2195 C(=C\C1COCCN1)/c2ccccc2 Amb32954622 [0,1,0,1,0,0|1,0,1]=4 3216 B15R2.2195 C(=C\C1NCCCO1)/c2ccccc2 Amb26445113 [0,1,0,1,0,0|1,0,1]=4 3217 B15R2.2195 C1=C(\C=C\c2ccccc2)CCNC1 Amb27747179 [0,1,0,1,0,0|2,0,0]=4 3218 B15R2.9941 CCNc1c(C)ccc2ccccc12 Amb18553378 [0,1,0,1,0,0|2,0,0]=4 3219 B15R2.9941 CCNc1c(O)ccc2ccccc12 Amb18054370 [0,1,0,1,0,0|1,0,1]=4 3220 B15R2.9941 CCOc1c(C)cnc2ccccc12 Amb27983316 [0,1,0,1,0,0|2,0,0]=4 3221 B15R2.9941 CCOc1c(I)ccc2ccccc12 Amb8392016 [0,1,0,1,0,0|1,0,0]=3 3222 B15R2.9941 CCOc1c(N)ccc2ccccc12 Amb28076113 [0,1,0,1,0,0|1,0,0]=3 3223 B15R2.9941 CCOc1c(N)cnc2ccccc12 Amb23402469 [0,1,0,1,0,0|2,0,0]=4 3224 B15R2.9941 CCOc1c(N)ncc2ccccc12 Amb18649916 [0,1,0,1,0,0|2,0,0]=4 3225 B15R2.9941 CSCc1c(N)ccc2ccccc12 Amb18654381 [0,1,0,1,0,0|2,0,0]=4 3226 B15R2.9941 Cc1ccc2ccccc2c1CCCl Amb28076990 [0,1,0,1,0,0|2,0,0]=4 3227 B15R2.9941 Cc1ccc2ccccc2c1CCN Amb17202000 [0,1,0,1,0,0|2,0,0]=4 3228 B15R2.9941 Cc1ccc2ccccc2c1CCO Amb25709028 [0,1,0,1,0,0|2,0,0]=4 3229 B15R2.9941 NCCN1C(=O)C=Cc2ccccc21 Amb18563358 [0,1,0,1,0,0|1,0,0]=3 3230 B15R2.9941 NCCN1C(=O)C=Nc2ccccc21 Amb18949321 [0,1,0,1,0,0|2,0,0]=4 3231 B15R2.9941 NCCc1c(F)ccc2ccccc12 Amb24054595 [0,1,0,1,0,0|2,0,0]=4 3232 B15R2.9941 NCCc1c(O)ccc2ccccc12 Amb6246482 [0,1,0,1,0,0|1,0,1]=4 3233 B15R2.9941 O=C1C=Cc2ccccc2N1CCBr Amb27668220 [0,1,0,1,0,0|1,0,0]=3 3234 B15R2.9941 O=C1C=Cc2ccccc2N1CCCl Amb28203241 [0,1,0,1,0,0|1,0,0]=3 3235 B15R2.9941 O=C1C=Cc2ccccc2N1CCS Amb27652623 [0,1,0,1,0,0|1,0,0]=3 3236 B15R2.9941 O=C1C=Nc2ccccc2N1CCS Amb27652614 [0,1,0,1,0,0|2,0,0]=4 3237 B15R2.9941 OCCc1c(O)ccc2ccccc12 Amb26409200 [0,1,0,1,0,0|1,0,1]=4 3238 B15R2.9941 Oc1ccc2ccccc2c1CCBr Amb33336334 [0,1,0,1,0,0|1,0,1]=4 3239 B15R2.9941 Oc1ccc2ccccc2c1CCS Amb33419909 [0,1,0,1,0,0|1,0,1]=4 3240 B15R2.24494 O=C(NCc1ccccc1)OC2CC2 Amb32697658 [0,1,0,1,0,0|1,0,1]=4 3241 B15R2.24494 O=C(\C=C\c1ccccc1)NC2CC2 Amb6319559 [0,1,0,1,0,0|1,0,0]=3 3242 B15R2.24494 O=C(\C=C\c1cccnc1)NC2CC2 Amb28124070 [0,1,0,1,0,0|2,0,0]=4 3243 B15R2.28 Cc1ccc(C2=CC(=O)CCC2)cn1 Amb28048714 [0,1,0,1,0,0|2,0,0]=4 3244 B15R2.28 Cc1ccc(C2CCOC(=O)C2)cc1 Amb28190717 [0,1,0,1,0,0|0,0,2]=4 3245 B15R2.28 Cc1ccc([C@H]2CCOC(=O)C2)cc1 Amb27957115 [0,1,0,1,0,0|0,0,2]=4 3246 B15R2.28 Nc1ccc(C2=CC(=O)CCC2)cc1 Amb27603582 [0,1,0,1,0,0|1,0,0]=3 3247 B15R2.28 Nc1ccc(N2CCOC(=O)C2)cc1 Amb27203373 [0,1,0,1,0,0|1,0,1]=4 3248 B15R2.28 O=C1C=C(c2ccc(Br)cc2)CCC1 Amb30021780 [0,1,0,1,0,0|1,0,0]=3 3249 B15R2.28 O=C1C=C(c2ccc(Cl)cc2)CCC1 Amb24348037 [0,1,0,1,0,0|1,0,0]=3 3250 B15R2.28 O=C1CC(c2ccc(Cl)cc2)CCO1 Amb25095898 [0,1,0,1,0,0|0,0,2]=4 3251 B15R2.28 O=C1CC(c2ccc(F)cc2)CCO1 Amb27259165 [0,1,0,1,0,0|0,0,2]=4 3252 B15R2.28 O=C1C[C@@H](c2ccc(Cl)cc2)CCO1 Amb27392823 [0,1,0,1,0,0|0,0,2]=4 3253 B15R2.28 O=C1NC(c2ccc(Br)cc2)CCO1 Amb28065105 [0,1,0,1,0,0|1,0,1]=4 3254 B15R2.28 O=C1NC(c2ccc(F)cc2)CCO1 Amb27665442 [0,1,0,1,0,0|1,0,1]=4 3255 B15R2.100 Clc1ccc(\C=C\C2=NCCS2)cc1 Amb27812010 [0,1,0,1,0,0|1,1,0]=4 3256 B15R2.309 CC1OC(=O)NC1c2ccc(Cl)cc2 Amb27174255 [0,1,0,1,0,0|1,0,1]=4 3257 B15R2.309 CC1OC(=O)NC1c2ccc(F)cc2 Amb27413563 [0,1,0,1,0,0|1,0,1]=4 3258 B15R2.309 CC1OC(=O)NC1c2ccc(O)cc2 Amb28430111 [0,1,0,1,0,0|1,0,1]=4 3259 B15R2.309 C[C@@H]1OC(=O)N[C@@H]1c2ccc(F)cc2 Amb28057811 [0,1,0,1,0,0|1,0,1]=4 3260 B15R2.309 C[C@@H]1OC(=O)N[C@H]1c2ccc(F)cc2 Amb28367709 [0,1,0,1,0,0|1,0,1]=4 3261 B15R2.309 C[C@H]1OC(=O)N[C@H]1c2ccc(Br)cc2 Amb28056029 [0,1,0,1,0,0|1,0,1]=4 3262 B15R2.309 Cc1ccc(C2=CC(=O)OC2=O)cc1 Amb23441682 [0,1,0,1,0,0|1,0,1]=4 3263 B15R2.309 O=C1C=C(c2ccc(Br)cc2)C(O)O1 Amb27387159 [0,1,0,1,0,0|1,0,0]=3 3264 B15R2.309 O=C1C=C(c2ccc(Cl)cc2)C(=O)O1 Amb2418051 [0,1,0,1,0,0|1,0,1]=4 3265 B15R2.309 O=C1C=C(c2ccc(F)cc2)C(=O)O1 Amb6806690 [0,1,0,1,0,0|1,0,1]=4 3266 B15R2.1282 CCCc1ccc2ccc(O)cc2c1 Amb32751567 [0,1,0,1,0,0|2,0,0]=4 3267 B15R2.1282 CCCc1ccc2ccc(O)cc2n1 Amb27256354 [0,1,0,1,0,0|2,0,0]=4 3268 B15R2.1282 CCNc1ccc2ccc(Cl)cc2n1 Amb28249457 [0,1,0,1,0,0|2,0,0]=4 3269 B15R2.1282 CCOc1ccc2c(c1)OC(=O)C=C2 Amb18511472 [0,1,0,1,0,0|2,0,0]=4 3270 B15R2.1282 CCOc1ccc2ccc(Br)cc2c1 Amb28388711 [0,1,0,1,0,0|1,0,0]=3 3271 B15R2.1282 CCOc1ccc2ccc(Br)cc2n1 Amb22494909 [0,1,0,1,0,0|1,0,0]=3 3272 B15R2.1282 CCOc1ccc2ccc(C)cc2c1 Amb26510964 [0,1,0,1,0,0|1,0,0]=3 3273 B15R2.1282 CCOc1ccc2ccc(O)cc2c1 Amb8837549 [0,1,0,1,0,0|1,0,0]=3 3274 B15R2.1282 CCOc1ccc2cnc(Cl)cc2c1 Amb33309326 [0,1,0,1,0,0|2,0,0]=4 3275 B15R2.1282 CCOc1ccc2cnc(O)cc2c1 Amb33309321 [0,1,0,1,0,0|2,0,0]=4 3276 B15R2.1282 CCOc1ccc2ncc(Br)cc2c1 Amb23449326 [0,1,0,1,0,0|2,0,0]=4 3277 B15R2.1282 CCOc1ccc2ncc(N)cc2c1 Amb17157140 [0,1,0,1,0,0|2,0,0]=4 3278 B15R2.1282 CCOc1cnc2ccc(Br)cc2c1 Amb22494959 [0,1,0,1,0,0|2,0,0]=4 3279 B15R2.1282 CCOc1ncc2ccc(Br)cc2n1 Amb27851626 [0,1,0,1,0,0|2,0,0]=4 3280 B15R2.1510 Cc1ccc(NN2CCOC2=O)cc1 Amb2642448 [0,1,0,1,0,0|2,0,0]=4 3281 B15R2.1510 Nc1ccc(CN2CCOC2=O)cc1 Amb6673364 [0,1,0,1,0,0|1,0,1]=4 3282 B15R2.1510 Nc1ccc(SC2CCOC2=O)cc1 Amb8930354 [0,1,0,1,0,0|1,0,1]=4 3283 B15R2.1510 O=C1CCC\C1=C/c2ccc(O)cc2 Amb18649860 [0,1,0,1,0,0|1,0,0]=3 3284 B15R2.1510 O=C1CCC\C1=C\c2ccc(O)cc2 Amb26451228 [0,1,0,1,0,0|1,0,0]=3 3285 B15R2.1510 O=C1NCC\C1=C/c2ccc(F)cc2 Amb27635788 [0,1,0,1,0,0|1,0,0]=3 3286 B15R2.1510 O=C1OCCC1Cc2ccc(O)cc2 Amb28461206 [0,1,0,1,0,0|0,0,2]=4 3287 B15R2.1510 O=C1OCCC1Nc2ccc(Br)cc2 Amb8262783 [0,1,0,1,0,0|1,0,1]=4 3288 B15R2.1510 O=C1OCCC1Oc2ccc(Cl)cc2 Amb25770917 [0,1,0,1,0,0|1,0,1]=4 3289 B15R2.1510 O=C1OCCC1Sc2ccc(O)cc2 Amb27769819 [0,1,0,1,0,0|1,0,1]=4 3290 B15R2.1510 O=C1OCCN1Cc2ccc(Cl)cc2 Amb22330640 [0,1,0,1,0,0|1,0,1]=4 3291 B15R2.1510 O=C1OCCN1Cc2ccc(I)cc2 Amb27606541 [0,1,0,1,0,0|1,0,1]=4 3292 B15R2.1510 O=C1OCC\C1=C/c2ccc(O)cc2 Amb19518102 [0,1,0,1,0,0|0,0,0]=2 3293 B15R2.1510 O=C1OCC\C1=C\c2ccc(O)cc2 Amb26958685 [0,1,0,1,0,0|0,0,0]=2 3294 B15R2.1510 O=C1OCS\C1=C\c2ccc(Cl)cc2 Amb25732575 [0,1,0,1,0,0|1,0,0]=3 3295 B15R2.1530 Nc1ccc(\C=C\C(=O)C2CC2)cc1 Amb28191301 [0,1,0,1,0,0|1,0,0]=3 3296 B15R2.1530 O=C(\C=C\c1ccc(Br)cc1)C2CC2 Amb6495983 [0,1,0,1,0,0|1,0,0]=3 3297 B15R2.1530 O=C(\C=C\c1ccc(Br)cc1)C2CO2 Amb27630378 [0,1,0,1,0,0|2,0,0]=4 3298 B15R2.1530 O=C(\C=C\c1ccc(Cl)cc1)C2CC2 Amb4129123 [0,1,0,1,0,0|1,0,0]=3 3299 B15R2.1530 O=C(\C=C\c1ccc(Cl)cc1)C2CO2 Amb27183079 [0,1,0,1,0,0|2,0,0]=4 3300 B15R2.1530 O=C(\C=C\c1ccc(F)cc1)C2CC2 Amb27950999 [0,1,0,1,0,0|1,0,0]=3 3301 B15R2.36352 CCN1C(=O)C=Cc2ccc(N)cc21 Amb26555035 [0,1,0,1,0,0|1,0,0]=3 3302 B15R2.36352 CCN1C(=O)C=Cc2ccc(N)nc21 Amb18650171 [0,1,0,1,0,0|2,0,0]=4 3303 B15R2.332 Cc1ccccc1[C@@H]2CCOC(=O)N2 Amb27811989 [0,1,0,1,0,0|1,0,1]=4 3304 B15R2.332 Nc1ccccc1C2=CC(=O)CCC2 Amb24652468 [0,1,0,1,0,0|1,0,0]=3 3305 B15R2.332 O=C1C=C(c2ccccc2Br)CCC1 Amb24361834 [0,1,0,1,0,0|1,0,0]=3 3306 B15R2.332 O=C1C=C(c2ccccc2Cl)CCC1 Amb25826953 [0,1,0,1,0,0|1,0,0]=3 3307 B15R2.332 O=C1C=C(c2ccccc2F)CCC1 Amb27223655 [0,1,0,1,0,0|1,0,0]=3 3308 B15R2.332 O=C1C=C(c2ccncc2F)CCC1 Amb27800707 [0,1,0,1,0,0|2,0,0]=4 3309 B15R2.332 O=C1NC(c2ccccc2Cl)CCO1 Amb27604417 [0,1,0,1,0,0|1,0,1]=4 3310 B15R2.332 O=C1N[C@@H](c2ccccc2Br)CCO1 Amb28136637 [0,1,0,1,0,0|1,0,1]=4 3311 B15R2.332 O=C1N[C@@H](c2ccccc2O)CCO1 Amb27483722 [0,1,0,1,0,0|1,0,1]=4 3312 B15R2.332 O=C1N[C@H](c2ccccc2Br)CCO1 Amb27222666 [0,1,0,1,0,0|1,0,1]=4 3313 B15R2.332 O=C1N[C@H](c2ccccc2O)CCO1 Amb27585890 [0,1,0,1,0,0|1,0,1]=4 3314 B15R2.359 Nc1ccccc1OC2CCOC2=O Amb18950830 [0,1,0,1,0,0|1,0,1]=4 3315 B15R2.359 O=C1OCC\C1=C/c2ccccc2O Amb22757608 [0,1,0,1,0,0|0,0,0]=2 3316 B15R2.359 O=C1OCS\C1=C/c2ccccc2O Amb26409201 [0,1,0,1,0,0|1,0,0]=3 3317 B15R2.359 O=C1SCC\C1=C/c2ccccc2O Amb28062992 [0,1,0,1,0,0|0,1,0]=3 3318 B15R2.557 CC1OC(=O)NC1c2ccccc2I Amb27774584 [0,1,0,1,0,0|1,0,1]=4 3319 B15R2.557 CN1OC(=O)C=C1c2ccccc2Br Amb27876853 [0,1,0,1,0,0|1,0,0]=3 3320 B15R2.557 CN1OC(=O)C=C1c2ccccc2N Amb27186633 [0,1,0,1,0,0|1,0,0]=3 3321 B15R2.557 C[C@@H]1OC(=O)N[C@@H]1c2ccccc2Br Amb28411345 [0,1,0,1,0,0|1,0,1]=4 3322 B15R2.557 C[C@H]1OC(=O)N[C@H]1c2ccccc2F Amb28056030 [0,1,0,1,0,0|1,0,1]=4 3323 B15R2.557 C[C@H]1OC(=O)N[C@H]1c2ccccc2O Amb28056219 [0,1,0,1,0,0|1,0,1]=4 3324 B15R2.557 Cc1cc(-c2ccccc2N)c(C)o1 Amb18945070 [0,1,0,1,0,0|1,0,1]=4 3325 B15R2.557 Cc1ccccc1[C@@H]2NC(=O)O[C@@H]2C Amb28132475 [0,1,0,1,0,0|1,0,1]=4 3326 B15R2.557 O=C1C=C(c2ccccc2F)C(=O)O1 Amb23441683 [0,1,0,1,0,0|1,0,1]=4 3327 B15R2.562 Nc1ccccc1\C=C\C2=NCCN2 Amb25901006 [0,1,0,1,0,0|2,0,0]=4 3328 B15R2.562 Oc1ccccc1\C=C\C2=CCCC2 Amb26624961 [0,1,0,1,0,0|2,0,0]=4 3329 B15R2.562 Oc1ccccc1\C=C\C2OCCO2 Amb25793660 [0,1,0,1,0,0|0,0,2]=4 3330 B15R2.1846 CCC1=Cc2ccccc2C=CC1=O Amb21948173 [0,1,0,1,0,0|1,0,0]=3 3331 B15R2.54379 CCCc1ccc2c(C)cccc2n1 Amb27832922 [0,1,0,1,0,0|2,0,0]=4 3332 B15R2.54379 CCNc1ccc2c(Cl)cccc2n1 Amb28256616 [0,1,0,1,0,0|2,0,0]=4 3333 B15R2.54379 CCOc1ccc2c(Br)nccc2c1 Amb18062822 [0,1,0,1,0,0|2,0,0]=4 3334 B15R2.54379 CCOc1ccc2c(Cl)nccc2c1 Amb17216945 [0,1,0,1,0,0|2,0,0]=4 3335 B15R2.54379 CCOc1ccc2c(N)cccc2c1 Amb24081670 [0,1,0,1,0,0|1,0,0]=3 3336 B15R2.54379 CCOc1ccc2c(N)nccc2c1 Amb17216966 [0,1,0,1,0,0|2,0,0]=4 3337 B15R2.54379 CCOc1ccc2c(O)ccnc2c1 Amb24111547 [0,1,0,1,0,0|2,0,0]=4 3338 B15R2.54379 CCOc1ccc2c(O)nccc2c1 Amb18062800 [0,1,0,1,0,0|2,0,0]=4 3339 B15R2.94 NC1CCC(c2ccccc2)=CC1=O Amb27231698 [0,1,0,1,0,0|1,0,0]=3 3340 B15R2.1601 CCC(=O)c1ccc2ccccc2c1 Amb4017274 [0,1,0,1,0,0|2,0,0]=4 3341 B15R2.1601 CCC(C)c1ccc2ccccc2c1 Amb28133819 [0,1,0,1,0,0|2,0,0]=4 3342 B15R2.1601 CCC(N)c1ccc2ccccc2c1 Amb18287330 [0,1,0,1,0,0|2,0,0]=4 3343 B15R2.1601 CCC(O)c1ccc2ccccc2n1 Amb28342661 [0,1,0,1,0,0|2,0,0]=4 3344 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2c1 Amb23440391 [0,1,0,1,0,0|2,0,0]=4 3345 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2c1 Amb27243952 [0,1,0,1,0,0|2,0,0]=4 3346 B15R2.1601 CC[C@@H](N)c1ccc2ccccc2n1 Amb28457192 [0,1,0,1,0,0|2,0,0]=4 3347 B15R2.1601 CC[C@@H](O)c1ccc2ccccc2c1 Amb27612746 [0,1,0,1,0,0|2,0,0]=4 3348 B15R2.1601 CC[C@H](N)c1ccc2ccccc2c1 Amb33802002 [0,1,0,1,0,0|2,0,0]=4 3349 B15R2.1601 CC[C@H](O)c1ccc2ccccc2c1 Amb28200346 [0,1,0,1,0,0|2,0,0]=4 3350 B15R2.24493 CC1(C(=O)\C=C\c2ccccc2)CO1 Amb539162 [0,1,0,1,0,0|2,0,0]=4 3351 B15R2.327 CC1(C)OC(=O)C=C1c2ccccc2 Amb19558252 [0,1,0,1,0,0|0,0,0]=2 3352 B15R2.327 CC1(C)OC(=O)NC1c2ccccc2 Amb25878763 [0,1,0,1,0,0|1,0,1]=4 3353 B15R2.327 CC1(C)OC(=O)N[C@@H]1c2ccccc2 Amb6357260 [0,1,0,1,0,0|1,0,1]=4 3354 B15R2.327 CC1(C)OC(=O)N[C@H]1c2ccccc2 Amb8515916 [0,1,0,1,0,0|1,0,1]=4 3355 B15R2.1162 CC(N)c1c(Cl)ccc2ccccc12 Amb27464770 [0,1,0,1,0,0|2,0,0]=4 3356 B15R2.1162 CC(N)c1c(O)ccc2ccccc12 Amb1993844 [0,1,0,1,0,0|1,0,1]=4 3357 B15R2.1162 CC(N)c1c(O)ccc2ccccc12 Amb1993997 [0,1,0,1,0,0|1,0,1]=4 3358 B15R2.1162 CC(O)c1c(Cl)ccc2ccccc12 Amb22270178 [0,1,0,1,0,0|2,0,0]=4 3359 B15R2.1162 CC(O)c1c(O)ccc2ccccc12 Amb18054369 [0,1,0,1,0,0|1,0,1]=4 3360 B15R2.1162 CN(C)N1C(=O)C=Cc2ccccc21 Amb27957012 [0,1,0,1,0,0|2,0,0]=4 3361 B15R2.1162 C[C@@H](N)c1c(Br)ccc2ccccc12 Amb27585671 [0,1,0,1,0,0|2,0,0]=4 3362 B15R2.1162 C[C@@H](N)c1c(F)ccc2ccccc12 Amb27602554 [0,1,0,1,0,0|2,0,0]=4 3363 B15R2.1162 C[C@@H](N)c1c(O)ccc2ccccc12 Amb27748297 [0,1,0,1,0,0|1,0,1]=4 3364 B15R2.1162 C[C@@H](O)c1c(O)ccc2ccccc12 Amb26876409 [0,1,0,1,0,0|1,0,1]=4 3365 B15R2.1162 C[C@H](N)c1c(O)ccc2ccccc12 Amb27632091 [0,1,0,1,0,0|1,0,1]=4 3366 B15R2.1162 C[C@H](O)c1c(O)ccc2ccccc12 Amb24462940 [0,1,0,1,0,0|1,0,1]=4 3367 B15R2.1162 Cc1ccc2ccccc2c1C(C)Br Amb27601795 [0,1,0,1,0,0|2,0,0]=4 3368 B15R2.1162 Cc1ccc2ccccc2c1[C@@H](C)N Amb28186652 [0,1,0,1,0,0|2,0,0]=4 3369 B15R2.1162 Cc1ccc2ccccc2c1[C@H](C)N Amb28322919 [0,1,0,1,0,0|2,0,0]=4 3370 B15R2.1668 CC(=O)Oc1ccc2ccccc2c1 Amb4065335 [0,1,0,1,0,0|1,0,1]=4 3371 B15R2.1668 CC(Br)Cc1ccc2ccccc2c1 Amb27836098 [0,1,0,1,0,0|2,0,0]=4 3372 B15R2.1668 CC(Br)Cc1ccc2ccccc2n1 Amb25731490 [0,1,0,1,0,0|2,0,0]=4 3373 B15R2.1668 CC(C)Cc1ccc2ccccc2n1 Amb8629133 [0,1,0,1,0,0|2,0,0]=4 3374 B15R2.1668 CC(C)Oc1ccc2ccccc2c1 Amb24358848 [0,1,0,1,0,0|1,0,0]=3 3375 B15R2.1668 CC(C)Oc1ccc2ccccc2n1 Amb28206293 [0,1,0,1,0,0|1,0,0]=3 3376 B15R2.1668 CC(C)Oc1ccc2cccnc2c1 Amb27959081 [0,1,0,1,0,0|2,0,0]=4 3377 B15R2.1668 CC(C)Oc1cnc2ccccc2c1 Amb27657092 [0,1,0,1,0,0|2,0,0]=4 3378 B15R2.1668 CC(C)Sc1ccc2ccccc2n1 Amb10665721 [0,1,0,1,0,0|1,1,0]=4 3379 B15R2.1668 CC(N)Cc1ccc2ccccc2c1 Amb9716016 [0,1,0,1,0,0|2,0,0]=4 3380 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb33550317 [0,1,0,1,0,0|2,0,0]=4 3381 B15R2.1668 CC(N)Cc1ccc2ccccc2n1 Amb9206046 [0,1,0,1,0,0|2,0,0]=4 3382 B15R2.1668 CC(O)Cc1ccc2ccccc2c1 Amb18319261 [0,1,0,1,0,0|2,0,0]=4 3383 B15R2.1668 CC(O)Cc1ccc2ccccc2n1 Amb20623273 [0,1,0,1,0,0|2,0,0]=4 3384 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2c1 Amb25213558 [0,1,0,1,0,0|2,0,0]=4 3385 B15R2.1668 C[C@@H](N)Cc1ccc2ccccc2n1 Amb33080324 [0,1,0,1,0,0|2,0,0]=4 3386 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2c1 Amb33361949 [0,1,0,1,0,0|2,0,0]=4 3387 B15R2.1668 C[C@@H](O)Cc1ccc2ccccc2n1 Amb33201374 [0,1,0,1,0,0|2,0,0]=4 3388 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2c1 Amb28246444 [0,1,0,1,0,0|2,0,0]=4 3389 B15R2.1668 C[C@H](N)Cc1ccc2ccccc2n1 Amb33448716 [0,1,0,1,0,0|2,0,0]=4 3390 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2c1 Amb33361951 [0,1,0,1,0,0|2,0,0]=4 3391 B15R2.1668 C[C@H](O)Cc1ccc2ccccc2n1 Amb33201375 [0,1,0,1,0,0|2,0,0]=4 3392 B15R2.1668 FC(F)Oc1ccc2ccccc2c1 Amb6331647 [0,1,0,1,0,0|2,0,0]=4 3393 B15R2.17 O\N=C1/C=C(c2ccccc2)CCC1 Amb27808724 [0,1,0,1,0,0|1,0,1]=4 3394 B15R2.1682 CC1CC(C=O)=CC1c2ccccc2 Amb28365196 [0,1,0,1,0,0|1,0,1]=4 3395 B15R2.1682 Cc1sc(C=O)cc1-c2ccccc2 Amb4056695 [0,1,0,1,0,0|0,1,1]=4 3396 B15R2.1682 Cn1nc(C=O)cc1-c2ccccc2 Amb2723856 [0,1,0,1,0,0|2,0,0]=4 3397 B15R2.1682 O=Cc1cc(-c2ccccc2)c(Br)o1 Amb26440899 [0,1,0,1,0,0|1,0,1]=4 3398 B15R2.2115 COc1c(C=O)ccc2ccccc12 Amb17594810 [0,1,0,1,0,0|2,0,0]=4 3399 B15R2.2115 O=Cc1ccc2ccccc2c1CBr Amb26849092 [0,1,0,1,0,0|2,0,0]=4 3400 B15R2.2115 O=Cc1ccc2ccccc2c1CCl Amb26078127 [0,1,0,1,0,0|2,0,0]=4 3401 B15R2.2115 O=Cc1ccc2ccccc2c1CO Amb27803879 [0,1,0,1,0,0|2,0,0]=4 3402 B15R2.2220 CCCc1ccc2ccccc2c1N Amb28121094 [0,1,0,1,0,0|2,0,0]=4 3403 B15R2.2220 CCO[C@H]1C=Cc2ccccc2[C@@H]1O Amb28194167 [0,1,0,1,0,0|0,0,2]=4 3404 B15R2.2220 CCOc1ccc2ccccc2c1Br Amb22490058 [0,1,0,1,0,0|1,0,0]=3 3405 B15R2.2220 CCOc1ccc2ccccc2c1C Amb25167822 [0,1,0,1,0,0|1,0,0]=3 3406 B15R2.2220 CCOc1ccc2ccccc2c1Cl Amb26331921 [0,1,0,1,0,0|1,0,0]=3 3407 B15R2.2220 CCOc1ccc2ccccc2c1F Amb26861348 [0,1,0,1,0,0|1,0,0]=3 3408 B15R2.2220 CCOc1ccc2ccccc2c1I Amb26857682 [0,1,0,1,0,0|1,0,0]=3 3409 B15R2.2220 CCOc1ccc2ccccc2c1N Amb17200241 [0,1,0,1,0,0|1,0,0]=3 3410 B15R2.2220 CCOc1ccc2ccccc2c1O Amb17200242 [0,1,0,1,0,0|0,0,1]=3 3411 B15R2.2220 CCOc1ccc2ccccc2c1S Amb26413934 [0,1,0,1,0,0|0,1,0]=3 3412 B15R2.2220 CCOc1ccc2ncccc2c1Br Amb23437323 [0,1,0,1,0,0|2,0,0]=4 3413 B15R2.2220 CCOc1ncc2ccccc2c1Cl Amb2609738 [0,1,0,1,0,0|2,0,0]=4 3414 B15R2.2220 CCSC1=CNc2ccccc2C1=O Amb26382867 [0,1,0,1,0,0|1,1,0]=4 3415 B15R2.71766 CCOC1(CN)C=Cc2ccccc21 Amb27762870 [0,1,0,1,0,0|1,0,1]=4 3416 B15R3.131 O=C1C=C(c2ccccc2)[C@@H]3C[C@H]13 Amb27199111 [0,0,0,2,0,0|1,0,0]=3 3417 B15R3.2249 O=C1CCn2c1cc3ccccc32 Amb18198639 [0,0,0,2,0,0|2,0,0]=4 3418 B15R3.2249 O=C1OCC2c3ccccc3NC12 Amb27818219 [0,0,0,2,0,0|1,0,1]=4 3419 B15R3.4266 c1ccc2cc3c(cc2c1)CCC3 Amb20248692 [0,0,0,2,0,0|2,0,0]=4 3420 B15R3.4266 c1ccc2nc3c(cc2c1)CCN3 Amb5723646 [0,0,0,2,0,0|2,0,0]=4 3421 B15R3.4266 c1ccc2nc3c(cc2c1)CCO3 Amb7101614 [0,0,0,2,0,0|1,0,0]=3 3422 B15R3.4266 c1ccc2nc3c(cc2c1)CCS3 Amb28193527 [0,0,0,2,0,0|1,1,0]=4 3423 B15R3.988 O=C1C=Cc2ccccc2C3CC13 Amb6359953 [0,0,0,2,0,0|1,0,0]=3 3424 B15R3.1738 C1=CC2(OCCO2)c3ccccc31 Amb22230761 [0,0,0,2,0,0|0,0,2]=4 3425 B15R3.1739 c1ccc2c3c(ccc2c1)NCC3 Amb26616102 [0,0,0,2,0,0|2,0,0]=4 3426 B15R3.794 Nc1ccc2cccc3c2c1CC3 Amb17594241 [0,0,0,2,0,0|2,0,0]=4 3427 B15R3.2009 O=C1C[C@H]2c3ccccc3C[C@H]2O1 Amb27471814 [0,0,0,2,0,0|0,0,2]=4 3428 B15R3.2009 O=C1NC2c3ccccc3CC2O1 Amb26904587 [0,0,0,2,0,0|1,0,1]=4 3429 B15R3.2009 O=C1N[C@H]2c3ccccc3C[C@H]2O1 Amb22336679 [0,0,0,2,0,0|1,0,1]=4 3430 B11R1.25 CCC(=O)\C=C\c1ccco1 Amb25233726 [1,0,0,0,1,0|1,0,0]=3 3431 B11R1.25 COC(=N)\C=C\c1ccco1 Amb27201924 [1,0,0,0,1,0|2,0,0]=4 3432 B11R1.25 COC(=O)\C=C\c1ccco1 Amb26473604 [1,0,0,0,1,0|1,0,0]=3 3433 B11R1.25 COC(=O)\C=C\c1cccs1 Amb2724557 [1,0,0,0,1,0|1,0,0]=3 3434 B11R1.25 COC(=O)\C=C\c1cccs1 Amb33714728 [1,0,0,0,1,0|1,0,0]=3 3435 B11R1.25 COC(=O)\C=C\c1ccno1 Amb27782507 [1,0,0,0,1,0|2,0,0]=4 3436 B11R1.25 COC(=O)\C=C\c1ccns1 Amb30013692 [1,0,0,0,1,0|2,0,0]=4 3437 B11R1.25 COC(=O)\C=C\c1ccsc1 Amb8630327 [1,0,0,0,1,0|1,0,0]=3 3438 B11R1.25 COC(=O)\C=C\c1cncs1 Amb25909810 [1,0,0,0,1,0|2,0,0]=4 3439 B11R1.25 COC(=O)\C=C\c1cocn1 Amb25208802 [1,0,0,0,1,0|2,0,0]=4 3440 B11R1.25 COC(=O)\C=C\c1cscn1 Amb24409150 [1,0,0,0,1,0|2,0,0]=4 3441 B11R1.25 COC(=O)\C=C\c1ncco1 Amb27398431 [1,0,0,0,1,0|2,0,0]=4 3442 B11R1.25 COC(=O)\C=C\c1nccs1 Amb25758463 [1,0,0,0,1,0|2,0,0]=4 3443 B11R1.25 COC(=O)\C=C\n1ccnc1 Amb25976817 [1,0,0,0,1,0|2,0,0]=4 3444 B11R1.25 O=C(\C=C\c1ccco1)CCl Amb26476618 [1,0,0,0,1,0|2,0,0]=4 3445 B11R1.25 O=C(\C=C\c1cccs1)CCl Amb28347537 [1,0,0,0,1,0|2,0,0]=4 3446 B11R1.40 C=C(CC)Nc1ccccc1 Amb27413657 [1,0,0,0,1,0|2,0,0]=4 3447 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [1,0,0,0,1,0|0,0,1]=3 3448 B11R1.40 CCC(=O)Cc1ccccn1 Amb9205933 [1,0,0,0,1,0|1,0,1]=4 3449 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [1,0,0,0,1,0|1,0,1]=4 3450 B11R1.40 CCC(=O)Nc1ccccc1 Amb6358816 [1,0,0,0,1,0|1,0,0]=3 3451 B11R1.40 CCC(=O)Nc1ccccn1 Amb3361354 [1,0,0,0,1,0|2,0,0]=4 3452 B11R1.40 CCC(=O)Nc1cccnc1 Amb5797495 [1,0,0,0,1,0|2,0,0]=4 3453 B11R1.40 CCC(=O)Oc1ccccc1 Amb2842289 [1,0,0,0,1,0|1,0,0]=3 3454 B11R1.40 CCC(=O)Sc1ccccc1 Amb26857967 [1,0,0,0,1,0|1,0,0]=3 3455 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [1,0,0,0,1,0|1,0,0]=3 3456 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [1,0,0,0,1,0|1,0,0]=3 3457 B11R1.40 CC\C(I)=C/c1ccccc1 Amb22641702 [1,0,0,0,1,0|1,0,0]=3 3458 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [1,0,0,0,1,0|1,0,1]=4 3459 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [1,0,0,0,1,0|2,0,0]=4 3460 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [1,0,0,0,1,0|2,0,0]=4 3461 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [1,0,0,0,1,0|2,0,0]=4 3462 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,0,0,0,1,0|1,0,1]=4 3463 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,0,0,0,1,0|1,0,1]=4 3464 B11R1.40 COC(=O)C[n+]1ccccc1 Amb26880684 [1,0,0,0,1,0|1,0,1]=4 3465 B11R1.40 COC(=O)C[n+]1ccccc1 Amb3433634 [1,0,0,0,1,0|1,0,1]=4 3466 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [1,0,0,0,1,0|0,0,1]=3 3467 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [1,0,0,0,1,0|1,0,1]=4 3468 B11R1.40 COC(=O)Cc1cccnc1 Amb22497118 [1,0,0,0,1,0|1,0,1]=4 3469 B11R1.40 COC(=O)Cc1cccnc1 Amb4017567 [1,0,0,0,1,0|1,0,1]=4 3470 B11R1.40 COC(=O)Cc1ccncc1 Amb20240688 [1,0,0,0,1,0|1,0,1]=4 3471 B11R1.40 COC(=O)Cc1ccncc1 Amb6892645 [1,0,0,0,1,0|1,0,1]=4 3472 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [1,0,0,0,1,0|1,0,0]=3 3473 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [1,0,0,0,1,0|2,0,0]=4 3474 B11R1.40 COC(=O)Nc1ccncc1 Amb8439516 [1,0,0,0,1,0|2,0,0]=4 3475 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [1,0,0,0,1,0|1,0,0]=3 3476 B11R1.40 COC(=S)Nc1ccccc1 Amb2731871 [1,0,0,0,1,0|1,1,0]=4 3477 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [1,0,0,0,1,0|1,0,0]=3 3478 B11R1.40 CO\C([O-])=N\c1ccccc1 Amb8488213 [1,0,0,0,1,0|1,0,1]=4 3479 B11R1.40 CSC(=O)Nc1ccccc1 Amb26618613 [1,0,0,0,1,0|1,1,0]=4 3480 B11R1.40 C\C(=C/c1ccccc1)CBr Amb33136396 [1,0,0,0,1,0|2,0,0]=4 3481 B11R1.40 C\C(=C/c1ccccc1)CCl Amb33136471 [1,0,0,0,1,0|2,0,0]=4 3482 B11R1.40 C\C(=C/c1ccccc1)CN Amb33136473 [1,0,0,0,1,0|2,0,0]=4 3483 B11R1.40 C\C(=C/c1ccccc1)CO Amb9825840 [1,0,0,0,1,0|2,0,0]=4 3484 B11R1.40 C\C(=C/c1ccccc1)CS Amb33381244 [1,0,0,0,1,0|2,0,0]=4 3485 B11R1.40 C\C(=C\c1ccccc1)CN Amb24634730 [1,0,0,0,1,0|2,0,0]=4 3486 B11R1.40 F\C(=C/c1ccccc1)CBr Amb27828070 [1,0,0,0,1,0|2,0,0]=4 3487 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [1,0,0,0,1,0|1,0,1]=4 3488 B11R1.40 NCC(=O)Cc1ccccc1 Amb33548503 [1,0,0,0,1,0|1,0,1]=4 3489 B11R1.40 NCC(=O)Nc1ccccc1 Amb33552339 [1,0,0,0,1,0|2,0,0]=4 3490 B11R1.40 NCC(=O)Nc1ccccc1 Amb6336661 [1,0,0,0,1,0|2,0,0]=4 3491 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [1,0,0,0,1,0|2,0,0]=4 3492 B11R1.40 NOC(=O)Oc1ccccc1 Amb27967373 [1,0,0,0,1,0|2,0,0]=4 3493 B11R1.40 O=C(CBr)Cc1ccccc1 Amb17569850 [1,0,0,0,1,0|1,0,1]=4 3494 B11R1.40 O=C(CBr)Nc1ccccc1 Amb2222053 [1,0,0,0,1,0|2,0,0]=4 3495 B11R1.40 O=C(CBr)Oc1ccccc1 Amb3940897 [1,0,0,0,1,0|2,0,0]=4 3496 B11R1.40 O=C(CCl)Cc1ccccc1 Amb2371529 [1,0,0,0,1,0|1,0,1]=4 3497 B11R1.40 O=C(CCl)Nc1ccccc1 Amb6333920 [1,0,0,0,1,0|2,0,0]=4 3498 B11R1.40 O=C(CCl)Oc1ccccc1 Amb1914503 [1,0,0,0,1,0|2,0,0]=4 3499 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [1,0,0,0,1,0|2,0,0]=4 3500 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [1,0,0,0,1,0|2,0,0]=4 3501 B11R1.40 O=C(CO)Nc1ccccc1 Amb1110212 [1,0,0,0,1,0|2,0,0]=4 3502 B11R1.40 O=C(CS)Nc1ccccc1 Amb1349645 [1,0,0,0,1,0|2,0,0]=4 3503 B11R1.40 OC\C(Cl)=C/c1ccccc1 Amb27234634 [1,0,0,0,1,0|2,0,0]=4 3504 B11R1.16 C#COC(=O)c1ccccc1 Amb25084221 [0,0,0,0,2,0|0,0,2]=4 3505 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [0,0,0,0,2,0|2,0,0]=4 3506 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [0,0,0,0,2,0|0,0,2]=4 3507 B11R1.16 CC#CC(=O)c1ccccc1 Amb17593622 [0,0,0,0,2,0|1,0,1]=4 3508 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [0,0,0,0,2,0|1,0,0]=3 3509 B11R1.16 CCCC(=O)c1ccccn1 Amb6301471 [0,0,0,0,2,0|2,0,0]=4 3510 B11R1.16 CCCC(=O)c1cccnc1 Amb17232054 [0,0,0,0,2,0|2,0,0]=4 3511 B11R1.16 CCCC(=O)c1ccncc1 Amb22235246 [0,0,0,0,2,0|2,0,0]=4 3512 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [0,0,0,0,2,0|2,0,0]=4 3513 B11R1.16 CCNC(=O)c1ccccc1 Amb6871002 [0,0,0,0,2,0|1,0,0]=3 3514 B11R1.16 CCNC(=O)c1ccccn1 Amb8439146 [0,0,0,0,2,0|2,0,0]=4 3515 B11R1.16 CCNC(=S)c1ccccc1 Amb27848073 [0,0,0,0,2,0|1,1,0]=4 3516 B11R1.16 CCNS(=O)c1ccccc1 Amb27261568 [0,0,0,0,2,0|2,0,0]=4 3517 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [0,0,0,0,2,0|1,0,0]=3 3518 B11R1.16 CCOC(=N)c1ccccc1 Amb33527262 [0,0,0,0,2,0|1,0,0]=3 3519 B11R1.16 CCOC(=N)c1cccnc1 Amb18179379 [0,0,0,0,2,0|2,0,0]=4 3520 B11R1.16 CCOC(=N)c1ccncc1 Amb18179378 [0,0,0,0,2,0|2,0,0]=4 3521 B11R1.16 CCOC(=O)C1=CC=CCC1 Amb32644787 [0,0,0,0,2,0|0,0,2]=4 3522 B11R1.16 CCOC(=O)c1ccccc1 Amb4302705 [0,0,0,0,2,0|0,0,0]=2 3523 B11R1.16 CCOC(=O)c1ccccn1 Amb3940414 [0,0,0,0,2,0|1,0,0]=3 3524 B11R1.16 CCOC(=O)c1cccnc1 Amb3940120 [0,0,0,0,2,0|1,0,0]=3 3525 B11R1.16 CCOC(=O)c1ccncc1 Amb1210124 [0,0,0,0,2,0|1,0,0]=3 3526 B11R1.16 CCOC(=O)c1ccncc1 Amb33140921 [0,0,0,0,2,0|1,0,0]=3 3527 B11R1.16 CCOC(=O)c1ccncn1 Amb8383933 [0,0,0,0,2,0|2,0,0]=4 3528 B11R1.16 CCOC(=O)c1ccnnc1 Amb8383938 [0,0,0,0,2,0|2,0,0]=4 3529 B11R1.16 CCOC(=O)c1cnccn1 Amb8428068 [0,0,0,0,2,0|2,0,0]=4 3530 B11R1.16 CCOC(=O)c1cncnc1 Amb8439525 [0,0,0,0,2,0|2,0,0]=4 3531 B11R1.16 CCOC(=O)c1ncccn1 Amb19930079 [0,0,0,0,2,0|2,0,0]=4 3532 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb5720188 [0,0,0,0,2,0|1,0,0]=3 3533 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [0,0,0,0,2,0|1,0,1]=4 3534 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [0,0,0,0,2,0|0,0,2]=4 3535 B11R1.16 CCON(C)c1ccccc1 Amb27234596 [0,0,0,0,2,0|2,0,0]=4 3536 B11R1.16 CCO[PH](=O)c1ccccc1 Amb10601587 [0,0,0,0,2,0|1,0,0]=3 3537 B11R1.16 CCSC(=O)c1ccccc1 Amb27828652 [0,0,0,0,2,0|0,1,0]=3 3538 B11R1.16 CC\C=C(/C)c1ccccc1 Amb25151168 [0,0,0,0,2,0|2,0,0]=4 3539 B11R1.16 CC\C=C(\C)c1ccccc1 Amb27445109 [0,0,0,0,2,0|2,0,0]=4 3540 B11R1.16 CC\[S+]=C(/N)c1ccccc1 Amb27236829 [0,0,0,0,2,0|1,1,0]=4 3541 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [0,0,0,0,2,0|2,0,0]=4 3542 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [0,0,0,0,2,0|1,0,0]=3 3543 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [0,0,0,0,2,0|2,0,0]=4 3544 B11R1.16 CONC(=O)c1ccccc1 Amb16969913 [0,0,0,0,2,0|2,0,0]=4 3545 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [0,0,0,0,2,0|2,0,0]=4 3546 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [0,0,0,0,2,0|1,0,1]=4 3547 B11R1.16 NCCC(=O)c1ccccc1 Amb2613669 [0,0,0,0,2,0|2,0,0]=4 3548 B11R1.16 O=C(CCBr)c1ccccc1 Amb4066411 [0,0,0,0,2,0|2,0,0]=4 3549 B11R1.16 O=C(CCCl)c1ccccc1 Amb3940266 [0,0,0,0,2,0|2,0,0]=4 3550 B11R1.16 O=C(CCO)c1ccccc1 Amb16231606 [0,0,0,0,2,0|2,0,0]=4 3551 B11R1.16 O=C(CCS)c1ccccc1 Amb17400214 [0,0,0,0,2,0|2,0,0]=4 3552 B11R1.16 O=C(NCCl)c1ccccc1 Amb7761622 [0,0,0,0,2,0|2,0,0]=4 3553 B11R1.16 O=C(NCO)c1ccccc1 Amb1200467 [0,0,0,0,2,0|2,0,0]=4 3554 B11R1.16 O=C(OCCl)c1ccccc1 Amb19958719 [0,0,0,0,2,0|1,0,0]=3 3555 B11R1.16 O=C(OCCl)c1cccnc1 Amb28343065 [0,0,0,0,2,0|2,0,0]=4 3556 B11R1.16 O=C(OCF)c1ccccc1 Amb27485928 [0,0,0,0,2,0|1,0,0]=3 3557 B11R1.16 O=C(OCI)c1ccccc1 Amb25148286 [0,0,0,0,2,0|1,0,0]=3 3558 B11R1.16 O=C(OCO)c1ccccc1 Amb25115920 [0,0,0,0,2,0|1,0,0]=3 3559 B11R1.16 O=C(SCCl)c1ccccc1 Amb28458380 [0,0,0,0,2,0|1,1,0]=4 3560 B11R1.16 O=COC(=O)c1ccccc1 Amb27421012 [0,0,0,0,2,0|1,0,1]=4 3561 B11R1.30 CCOC(=O)Cc1ccco1 Amb27266773 [0,0,0,0,2,0|1,0,1]=4 3562 B11R1.30 CCOC(=O)Cc1cccs1 Amb2687957 [0,0,0,0,2,0|1,0,1]=4 3563 B11R1.30 CCOC(=O)Cc1ccoc1 Amb27266772 [0,0,0,0,2,0|1,0,1]=4 3564 B11R1.30 CCOC(=O)Cc1ccsc1 Amb33531521 [0,0,0,0,2,0|1,0,1]=4 3565 B11R1.30 CCOC(=O)Cn1cccc1 Amb2236263 [0,0,0,0,2,0|1,0,1]=4 3566 B11R1.30 CCOC(=O)Nc1ccco1 Amb24744539 [0,0,0,0,2,0|2,0,0]=4 3567 B15R1.778 CCCC(=O)OC\C=C\c1ccccc1 Amb6297856 [0,0,0,0,0,2|1,0,0]=3 3568 B15R1.778 CCOC(=O)CCCOc1ccccc1 Amb22730739 [0,0,0,0,0,2|0,0,2]=4 3569 B15R1.778 CCOC(=O)CCCSc1ccccc1 Amb19888704 [0,0,0,0,0,2|0,0,2]=4 3570 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb1930738 [0,0,0,0,0,2|0,0,2]=4 3571 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb33280205 [0,0,0,0,0,2|0,0,2]=4 3572 B15R1.778 CCOC(=O)CCOCc1ccccc1 Amb9026131 [0,0,0,0,0,2|0,0,2]=4 3573 B15R1.778 CCOC(=O)CNCCc1ccccc1 Amb6711761 [0,0,0,0,0,2|0,0,2]=4 3574 B15R1.778 CCOC(=O)CNOCc1ccccc1 Amb13884841 [0,0,0,0,0,2|0,0,2]=4 3575 B15R1.778 CCOC(=O)NNCCc1ccccc1 Amb24103548 [0,0,0,0,0,2|0,0,2]=4 3576 B15R1.778 CCOC(=O)\C=C\NCc1ccccc1 Amb27966691 [0,0,0,0,0,2|0,0,0]=2