0 B13R1.718 BrCC(=O)NCCc1ccccc1 Amb2089064 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.718 BrCC(=O)NCCc1ccccn1 Amb17323242 [0,0,0,0,0,0|4,0,0]=4 2 B13R1.718 C#CC(=O)COCc1ccccc1 Amb25697113 [0,0,0,0,0,0|2,0,1]=3 3 B13R1.718 C#CC(=O)C\C=C\c1ccccc1 Amb25706938 [0,0,0,0,0,0|1,0,3]=4 4 B13R1.718 C#CC(=O)NCCc1cc[n]cc1 Amb25051109 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.718 C#CC(=O)NCCc1ccc[n]c1 Amb25795245 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.718 C#CC(=O)NCCc1cccc[n]1 Amb24397559 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.718 C#CC(=O)NCCc1ccccc1 Amb25349378 [0,0,0,0,0,0|2,0,1]=3 8 B13R1.718 C#CC(=O)NOCc1ccccc1 Amb25755722 [0,0,0,0,0,0|3,0,1]=4 9 B13R1.718 C=C(CN)COCc1ccccc1 Amb24560965 [0,0,0,0,0,0|4,0,0]=4 10 B13R1.718 C=C(CNCc1ccccc1)C=C Amb25312120 [0,0,0,0,0,0|3,0,1]=4 11 B13R1.718 C=C(CO)CNCc1ccccc1 Amb24375679 [0,0,0,0,0,0|4,0,0]=4 12 B13R1.718 C=C(CS)COCc1ccccc1 Amb24389998 [0,0,0,0,0,0|4,0,0]=4 13 B13R1.718 C=CC(=O)NOCc1ccccc1 Amb24684331 [0,0,0,0,0,0|3,0,1]=4 14 B13R1.718 C=CC(=O)OCCc1ccccc1 Amb17934131 [0,0,0,0,0,0|2,0,1]=3 15 B13R1.718 CC(CNCc1ccccc1)=C=C Amb25363323 [0,0,0,0,0,0|3,0,1]=4 16 B13R1.718 CCC(=O)C=C=Cc1ccccc1 Amb25713065 [0,0,0,0,0,0|1,0,3]=4 17 B13R1.718 CCC(=O)CCCc1ccccc1 Amb17138784 [0,0,0,0,0,0|1,0,0]=1 18 B13R1.718 CCC(=O)COCc1ccccc1 Amb18186198 [0,0,0,0,0,0|2,0,0]=2 19 B13R1.718 CCC(=O)NCCc1cc[n]cc1 Amb24073074 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.718 CCC(=O)NOCc1ccccc1 Amb15742563 [0,0,0,0,0,0|3,0,0]=3 21 B13R1.718 CCC(=O)N\C=C\c1ccccc1 Amb10561812 [0,0,0,0,0,0|2,0,2]=4 22 B13R1.718 CCC(CCSc1ccccc1)N Amb13881553 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.718 CCC(N)CNCc1ccccc1 Amb18796071 [0,0,0,0,0,0|3,0,1]=4 24 B13R1.718 CCC(N)COCc1ccccc1 Amb18809231 [0,0,0,0,0,0|3,0,1]=4 25 B13R1.718 CCC(NCCc1ccccc1)C Amb2119578 [0,0,0,0,0,0|3,0,1]=4 26 B13R1.718 CCC(O)COCc1ccccc1 Amb18186601 [0,0,0,0,0,0|2,0,2]=4 27 B13R1.718 CCC(S)CNCc1ccccc1 Amb25063526 [0,0,0,0,0,0|2,1,1]=4 28 B13R1.718 CC[C@@H](C)CNCc1ccccc1 Amb24594347 [0,0,0,0,0,0|3,0,1]=4 29 B13R1.718 CC[C@@H](N)CNCc1ccccc1 Amb25303180 [0,0,0,0,0,0|3,0,1]=4 30 B13R1.718 CC[C@@H](O)COCc1ccccc1 Amb22225151 [0,0,0,0,0,0|2,0,2]=4 31 B13R1.718 CC[C@H](C)CNCc1ccccc1 Amb24489041 [0,0,0,0,0,0|3,0,1]=4 32 B13R1.718 CC[C@H](CNCc1ccccc1)O Amb10067150 [0,0,0,0,0,0|2,0,2]=4 33 B13R1.718 CC[C@H](N)CNCc1ccccc1 Amb25125387 [0,0,0,0,0,0|3,0,1]=4 34 B13R1.718 CC[C@H](N)COCc1ccccc1 Amb24417715 [0,0,0,0,0,0|3,0,1]=4 35 B13R1.718 CC\C(\N)=N\OCc1ccccc1 Amb24626643 [0,0,0,0,0,0|4,0,0]=4 36 B13R1.718 CNC(=N)COCc1ccccc1 Amb24607701 [0,0,0,0,0,0|3,0,0]=3 37 B13R1.718 CNC(=N)NCCc1cc[n]cc1 Amb18184397 [0,0,0,0,0,0|4,0,0]=4 38 B13R1.718 CNC(=N)NCCc1ccc[n]c1 Amb18804783 [0,0,0,0,0,0|4,0,0]=4 39 B13R1.718 CNC(=N)NCCc1cccc[n]1 Amb18804782 [0,0,0,0,0,0|4,0,0]=4 40 B13R1.718 CNC(=N)NCCc1ccccc1 Amb18804663 [0,0,0,0,0,0|3,0,0]=3 41 B13R1.718 CNC(=N)NNCc1ccccc1 Amb25729841 [0,0,0,0,0,0|4,0,0]=4 42 B13R1.718 CNC(=O)CCNc1[n]ccc[n]1 Amb18796239 [0,0,0,0,0,0|4,0,0]=4 43 B13R1.718 CNC(=O)CCNc1c[n]cc[n]1 Amb18181094 [0,0,0,0,0,0|4,0,0]=4 44 B13R1.718 CNC(=O)CCNc1cc[n]c[n]1 Amb18186570 [0,0,0,0,0,0|4,0,0]=4 45 B13R1.718 CNC(=O)CCNc1cc[n]cc1 Amb18186363 [0,0,0,0,0,0|3,0,0]=3 46 B13R1.718 CNC(=O)CCNc1ccc[n][n]1 Amb19023364 [0,0,0,0,0,0|4,0,0]=4 47 B13R1.718 CNC(=O)CCNc1cccc[n]1 Amb18186362 [0,0,0,0,0,0|3,0,0]=3 48 B13R1.718 CNC(=O)CCNc1ccccc1 Amb18180793 [0,0,0,0,0,0|2,0,0]=2 49 B13R1.718 CNC(=O)C\C=C\c1ccccc1 Amb25857434 [0,0,0,0,0,0|1,0,2]=3 50 B13R1.718 CNC(=O)NCCc1cc[n]cc1 Amb22584239 [0,0,0,0,0,0|3,0,0]=3 51 B13R1.718 CNC(=O)NCCc1ccc[n]c1 Amb22584252 [0,0,0,0,0,0|3,0,0]=3 52 B13R1.718 CNC(=O)NCCc1cccc[n]1 Amb22584238 [0,0,0,0,0,0|3,0,0]=3 53 B13R1.718 CNC(=O)NCCc1ccccc1 Amb2132768 [0,0,0,0,0,0|2,0,0]=2 54 B13R1.718 CNC(=O)\C=C/Sc1ccccc1 Amb24669067 [0,0,0,0,0,0|2,0,2]=4 55 B13R1.718 CNC(=O)\C=N\Nc1ccccc1 Amb24444432 [0,0,0,0,0,0|3,0,1]=4 56 B13R1.718 CNC(=S)NNCc1ccccc1 Amb25826591 [0,0,0,0,0,0|3,1,0]=4 57 B13R1.718 CNC(=S)NOCc1ccccc1 Amb25805223 [0,0,0,0,0,0|3,1,0]=4 58 B13R1.718 CNC(C)CNCc1ccccc1 Amb18184455 [0,0,0,0,0,0|3,0,1]=4 59 B13R1.718 CNC(C)COCc1ccccc1 Amb18809230 [0,0,0,0,0,0|3,0,1]=4 60 B13R1.718 CN[C@@H](C)CNCc1ccccc1 Amb25201911 [0,0,0,0,0,0|3,0,1]=4 61 B13R1.718 COC(=N)CNCc1ccccc1 Amb25074070 [0,0,0,0,0,0|2,0,0]=2 62 B13R1.718 COC(=N)COCc1ccccc1 Amb24607698 [0,0,0,0,0,0|2,0,0]=2 63 B13R1.718 COC(=O)C#CCc1c[n]ccc1 Amb24406047 [0,0,0,0,0,0|1,0,2]=3 64 B13R1.718 COC(=O)C#CCc1ccccc1 Amb24623934 [0,0,0,0,0,0|0,0,2]=2 65 B13R1.718 COC(=O)CC#Cc1ccccc1 Amb25763626 [0,0,0,0,0,0|0,0,2]=2 66 B13R1.718 COC(=O)CCCc1cc[n]cc1 Amb19888651 [0,0,0,0,0,0|1,0,0]=1 67 B13R1.718 COC(=O)CCCc1ccc[n]c1 Amb24066737 [0,0,0,0,0,0|1,0,0]=1 68 B13R1.718 COC(=O)CCNc1ccc[n]c1 Amb18933308 [0,0,0,0,0,0|2,0,0]=2 69 B13R1.718 COC(=O)CCNc1ccccc1 Amb1930724 [0,0,0,0,0,0|1,0,0]=1 70 B13R1.718 COC(=O)CCNc1ccccn1 Amb1243208 [0,0,0,0,0,0|2,0,0]=2 71 B13R1.718 COC(=O)CC[NH2+]c1ccccc1 Amb10553942 [0,0,0,0,0,0|1,0,0]=1 72 B13R1.718 COC(=O)CNCc1ccccc1 Amb21929289 [0,0,0,0,0,0|1,0,0]=1 73 B13R1.718 COC(=O)C\C=C\c1ccccc1 Amb10563169 [0,0,0,0,0,0|0,0,2]=2 74 B13R1.718 COC(=O)C\N=C\c1ccccc1 Amb22232615 [0,0,0,0,0,0|1,0,1]=2 75 B13R1.718 COC(=O)NCCc1ccncc1 Amb1089154 [0,0,0,0,0,0|2,0,0]=2 76 B13R1.718 COC(=O)NOCc1ccccc1 Amb25359225 [0,0,0,0,0,0|2,0,0]=2 77 B13R1.718 COC(=O)N\C=C\c1ccccc1 Amb20001007 [0,0,0,0,0,0|1,0,2]=3 78 B13R1.718 COC(=O)N\N=C\c1ccccc1 Amb2411289 [0,0,0,0,0,0|2,0,1]=3 79 B13R1.718 COC(=O)\C=C\Nc1ccccc1 Amb2386662 [0,0,0,0,0,0|1,0,2]=3 80 B13R1.718 COC(=O)\C=N/Nc1ccccc1 Amb24460271 [0,0,0,0,0,0|2,0,1]=3 81 B13R1.718 COC(C)CNCc1ccccc1 Amb23570905 [0,0,0,0,0,0|2,0,1]=3 82 B13R1.718 CON(C)CC#Cc1ccccc1 Amb25787926 [0,0,0,0,0,0|2,0,2]=4 83 B13R1.718 CSC(C)CNCc1ccccc1 Amb24425283 [0,0,0,0,0,0|2,1,1]=4 84 B13R1.718 C\C(\CC)=N/OCc1ccccc1 Amb24414826 [0,0,0,0,0,0|4,0,0]=4 85 B13R1.718 C\C(\CNCc1ccccc1)=C/C Amb18127531 [0,0,0,0,0,0|3,0,0]=3 86 B13R1.718 C\C(\CNCc1ccccc1)=C\C Amb24414647 [0,0,0,0,0,0|3,0,0]=3 87 B13R1.718 ClCC(=O)NCCc1ccncc1 Amb17333280 [0,0,0,0,0,0|4,0,0]=4 88 B13R1.718 N#CC(=O)NCCc1ccccc1 Amb25725944 [0,0,0,0,0,0|3,0,0]=3 89 B13R1.718 NC(NCCc1ccccc1)=NO Amb18809201 [0,0,0,0,0,0|4,0,0]=4 90 B13R1.718 NCC(=O)NCCc1ccccc1 Amb13951619 [0,0,0,0,0,0|3,0,0]=3 91 B13R1.718 NNC(=O)CCNc1ccccc1 Amb10607892 [0,0,0,0,0,0|3,0,0]=3 92 B13R1.718 NNC(=O)CNCc1ccccc1 Amb21967920 [0,0,0,0,0,0|3,0,0]=3 93 B13R1.718 NNC(=O)C\C=C\c1ccccc1 Amb24540797 [0,0,0,0,0,0|2,0,2]=4 94 B13R1.718 NNC(=O)NCCc1cc[n]cc1 Amb18181088 [0,0,0,0,0,0|4,0,0]=4 95 B13R1.718 NNC(=O)NCCc1ccc[n]c1 Amb18181087 [0,0,0,0,0,0|4,0,0]=4 96 B13R1.718 NNC(=O)NNCc1ccccc1 Amb24501441 [0,0,0,0,0,0|4,0,0]=4 97 B13R1.718 NNC(=O)NOCc1ccccc1 Amb25251822 [0,0,0,0,0,0|4,0,0]=4 98 B13R1.718 N\C(\CCCc1ccccc1)=N\O Amb22551827 [0,0,0,0,0,0|3,0,0]=3 99 B13R1.718 N\C(\NCCc1ccccc1)=N\N Amb24573776 [0,0,0,0,0,0|4,0,0]=4 100 B13R1.718 O=C(CCl)CCCc1ccccc1 Amb22395307 [0,0,0,0,0,0|2,0,0]=2 101 B13R1.718 O=C(CCl)CCSc1ccccc1 Amb22395335 [0,0,0,0,0,0|3,0,0]=3 102 B13R1.718 O=C(CCl)COCc1ccccc1 Amb24738350 [0,0,0,0,0,0|3,0,0]=3 103 B13R1.718 O=C(CCl)CSCc1ccccc1 Amb22395293 [0,0,0,0,0,0|3,0,0]=3 104 B13R1.718 O=C(CCl)NCCc1ccc[n]c1 Amb19056184 [0,0,0,0,0,0|4,0,0]=4 105 B13R1.718 OCC(=O)COCc1ccccc1 Amb24555141 [0,0,0,0,0,0|3,0,0]=3 106 B13R1.718 OCC(=O)NCCc1ccccc1 Amb1111400 [0,0,0,0,0,0|3,0,0]=3 107 B13R1.718 ONC(=O)CC#Cc1ccccc1 Amb24645077 [0,0,0,0,0,0|2,0,2]=4 108 B13R1.718 ONC(=O)COCc1ccccc1 Amb25072046 [0,0,0,0,0,0|3,0,0]=3 109 B13R1.718 ONC(=O)NCCc1ccccc1 Amb25112138 [0,0,0,0,0,0|3,0,0]=3 110 B12R1.8 C=C=CCNCc1ccccc1 Amb25775091 [1,0,0,0,0,0|2,0,1]=4 111 B12R1.8 C=CCCCCc1ccccc1 Amb19930233 [1,0,0,0,0,0|1,0,2]=4 112 B12R1.8 C=C\C=C\CCc1ccccc1 Amb20248567 [1,0,0,0,0,0|1,0,2]=4 113 B12R1.8 CC#CCNCc1ccccc1 Amb10233665 [1,0,0,0,0,0|2,0,1]=4 114 B12R1.8 CC#CCSCc1ccccc1 Amb25788750 [1,0,0,0,0,0|2,0,1]=4 115 B12R1.8 CCCCCCc1cc[n]cc1 Amb22235257 [1,0,0,0,0,0|2,0,1]=4 116 B12R1.8 CCCCCCc1cccnc1 Amb10807465 [1,0,0,0,0,0|2,0,1]=4 117 B12R1.8 CCCCCOc1ccccc1 Amb1106330 [1,0,0,0,0,0|2,0,1]=4 118 B12R1.8 CCCNCCc1ccccc1 Amb2119486 [1,0,0,0,0,0|2,0,1]=4 119 B12R1.8 CCNCCCc1ccccc1 Amb2094490 [1,0,0,0,0,0|2,0,0]=3 120 B12R1.8 CCNCCNc1ccccc1 Amb18792597 [1,0,0,0,0,0|3,0,0]=4 121 B12R1.8 CCNCCOc1ccccc1 Amb2099717 [1,0,0,0,0,0|3,0,0]=4 122 B12R1.8 CCNCCSc1ccccc1 Amb10608724 [1,0,0,0,0,0|3,0,0]=4 123 B12R1.8 CCOCCCc1ccccc1 Amb24063530 [1,0,0,0,0,0|2,0,0]=3 124 B12R1.8 CCSCCNc1ccccc1 Amb17307513 [1,0,0,0,0,0|3,0,0]=4 125 B12R1.8 CC\C=C\NCc1ccccc1 Amb24519259 [1,0,0,0,0,0|2,0,1]=4 126 B12R1.8 CC\C=N\OCc1ccccc1 Amb24395281 [1,0,0,0,0,0|3,0,0]=4 127 B12R1.8 CNCCCCc1ccccc1 Amb10068774 [1,0,0,0,0,0|1,0,1]=3 128 B12R1.8 CNCCCCc1cccnc1 Amb17617748 [1,0,0,0,0,0|2,0,1]=4 129 B12R1.8 CNCCCNc1ccccc1 Amb13951704 [1,0,0,0,0,0|2,0,1]=4 130 B12R1.8 CNCCCSc1ccccc1 Amb10608730 [1,0,0,0,0,0|2,0,1]=4 131 B12R1.8 CNCCCSc1ccccc1 Amb22588097 [1,0,0,0,0,0|2,0,1]=4 132 B12R1.8 CNCCOCc1ccccc1 Amb20668782 [1,0,0,0,0,0|2,0,1]=4 133 B12R1.8 CNCCSCc1ccccc1 Amb18809641 [1,0,0,0,0,0|2,0,1]=4 134 B12R1.8 COCCCNc1ccccc1 Amb17232551 [1,0,0,0,0,0|1,0,1]=3 135 B12R1.8 COCCCOc1ccccc1 Amb23450364 [1,0,0,0,0,0|1,0,1]=3 136 B12R1.8 COCCNCc1ccccn1 Amb1663439 [1,0,0,0,0,0|2,0,1]=4 137 B12R1.8 COCCNCc1ccccn1 Amb17622505 [1,0,0,0,0,0|2,0,1]=4 138 B12R1.8 CONCC#Cc1ccccc1 Amb25139183 [1,0,0,0,0,0|1,0,2]=4 139 B12R1.8 CSCCNCc1ccccc1 Amb18187025 [1,0,0,0,0,0|1,1,1]=4 140 B12R1.8 CS\C=C/CNc1ccccc1 Amb25312228 [1,0,0,0,0,0|1,1,1]=4 141 B12R1.8 CS\C=C\CNc1ccccc1 Amb25167583 [1,0,0,0,0,0|1,1,1]=4 142 B12R1.8 C\C=C\CNCc1ccccc1 Amb18645560 [1,0,0,0,0,0|2,0,0]=3 143 B12R1.8 ClCCCCCc1ccccc1 Amb10808064 [1,0,0,0,0,0|2,0,1]=4 144 B12R1.8 Cl[Zn]CCCCc1ccccc1 Amb22897864 [1,0,0,0,0,0|2,0,1]=4 145 B12R1.8 Cl\C=C/COCc1ccccc1 Amb24711309 [1,0,0,0,0,0|3,0,0]=4 146 B12R1.8 N#C\C=C\CCc1ccccc1 Amb17477529 [1,0,0,0,0,0|2,0,1]=4 147 B12R1.8 NCCCCCc1ccccc1 Amb18034503 [1,0,0,0,0,0|2,0,1]=4 148 B12R1.8 NOCCOCc1ccccc1 Amb22896393 [1,0,0,0,0,0|2,0,1]=4 149 B12R1.8 O=CCCCCc1ccccc1 Amb18798121 [1,0,0,0,0,0|2,0,1]=4 150 B12R1.8 O=COCCCc1ccccc1 Amb22229401 [1,0,0,0,0,0|3,0,0]=4 151 B12R1.8 O\C=C\NCCc1ccccc1 Amb24721604 [1,0,0,0,0,0|3,0,0]=4 152 B12R1.8 [N-]=[N+]=NCCCc1ccccc1 Amb10572439 [1,0,0,0,0,0|3,0,0]=4 153 B12R1.252 BrC(=C)CNCc1ccccc1 Amb1774594 [1,0,0,0,0,0|2,0,1]=4 154 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [1,0,0,0,0,0|2,0,1]=4 155 B12R1.252 C=C(Cl)CNCc1ccccc1 Amb19004833 [1,0,0,0,0,0|2,0,1]=4 156 B12R1.252 C=C(F)CNCc1ccccc1 Amb25060778 [1,0,0,0,0,0|2,0,1]=4 157 B12R1.252 CC(=C)CCNc1cccc[n]1 Amb25273311 [1,0,0,0,0,0|3,0,0]=4 158 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [1,0,0,0,0,0|2,0,0]=3 159 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [1,0,0,0,0,0|2,0,0]=3 160 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [1,0,0,0,0,0|2,0,0]=3 161 B12R1.252 CC(=N)NCCc1cc[n]cc1 Amb25148471 [1,0,0,0,0,0|3,0,0]=4 162 B12R1.252 CC(=N)NCCc1ccc[n]c1 Amb25148470 [1,0,0,0,0,0|3,0,0]=4 163 B12R1.252 CC(=N)NCCc1cccc[n]1 Amb25051604 [1,0,0,0,0,0|3,0,0]=4 164 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [1,0,0,0,0,0|2,0,0]=3 165 B12R1.252 CC(=O)C#CSc1ccccc1 Amb25767013 [1,0,0,0,0,0|1,0,2]=4 166 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [1,0,0,0,0,0|1,0,0]=2 167 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [1,0,0,0,0,0|1,0,0]=2 168 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [1,0,0,0,0,0|1,0,0]=2 169 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,0|0,0,2]=3 170 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,0|1,0,1]=3 171 B12R1.252 CC(=O)NCCc1c[n]cc[n]1 Amb25277212 [1,0,0,0,0,0|3,0,0]=4 172 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [1,0,0,0,0,0|2,0,0]=3 173 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [1,0,0,0,0,0|2,0,0]=3 174 B12R1.252 CC(=O)NOCc1ccc[n]c1 Amb24420633 [1,0,0,0,0,0|3,0,0]=4 175 B12R1.252 CC(=O)NOCc1cccc[n]1 Amb25077790 [1,0,0,0,0,0|3,0,0]=4 176 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [1,0,0,0,0,0|2,0,0]=3 177 B12R1.252 CC(=O)OCOc1cccc[n]1 Amb24100497 [1,0,0,0,0,0|3,0,0]=4 178 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [1,0,0,0,0,0|2,0,0]=3 179 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [1,0,0,0,0,0|1,0,2]=4 180 B12R1.252 CC(=O)SCCc1ccccn1 Amb17619708 [1,0,0,0,0,0|2,0,0]=3 181 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [1,0,0,0,0,0|1,0,2]=4 182 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [1,0,0,0,0,0|1,0,2]=4 183 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [1,0,0,0,0,0|0,0,2]=3 184 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [1,0,0,0,0,0|1,0,2]=4 185 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [1,0,0,0,0,0|1,0,2]=4 186 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [1,0,0,0,0,0|2,0,1]=4 187 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [1,0,0,0,0,0|2,0,1]=4 188 B12R1.252 CC(Br)CCSc1ccccc1 Amb20623511 [1,0,0,0,0,0|2,0,1]=4 189 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,0|1,0,1]=3 190 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [1,0,0,0,0,0|3,0,0]=4 191 B12R1.252 CC(C)CCCc1ccccc1 Amb24063684 [1,0,0,0,0,0|1,0,1]=3 192 B12R1.252 CC(C)CCOc1ccccc1 Amb23450363 [1,0,0,0,0,0|2,0,1]=4 193 B12R1.252 CC(C)CNCc1ccccc1 Amb22586944 [1,0,0,0,0,0|2,0,1]=4 194 B12R1.252 CC(CCCc1ccccc1)Cl Amb17477428 [1,0,0,0,0,0|1,0,1]=3 195 B12R1.252 CC(CCCc1ccccc1)O Amb17138575 [1,0,0,0,0,0|0,0,2]=3 196 B12R1.252 CC(CCCc1ccccn1)C Amb10573555 [1,0,0,0,0,0|2,0,1]=4 197 B12R1.252 CC(CCCc1cccnc1)N Amb17232504 [1,0,0,0,0,0|2,0,1]=4 198 B12R1.252 CC(CCSc1ccccc1)N Amb13881552 [1,0,0,0,0,0|2,0,1]=4 199 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [1,0,0,0,0,0|2,0,1]=4 200 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [1,0,0,0,0,0|2,0,1]=4 201 B12R1.252 CC(F)CCCc1ccccc1 Amb22229780 [1,0,0,0,0,0|1,0,1]=3 202 B12R1.252 CC(F)CNCc1ccccc1 Amb25795376 [1,0,0,0,0,0|2,0,1]=4 203 B12R1.252 CC(I)CCCc1ccccc1 Amb22274883 [1,0,0,0,0,0|1,0,1]=3 204 B12R1.252 CC(N)CCNc1ccccc1 Amb19009675 [1,0,0,0,0,0|2,0,1]=4 205 B12R1.252 CC(N)CNCc1ccccc1 Amb18305296 [1,0,0,0,0,0|2,0,1]=4 206 B12R1.252 CC(NCCc1ccccc1)C Amb2111109 [1,0,0,0,0,0|2,0,1]=4 207 B12R1.252 CC(O)CCCc1c[n]ccc1 Amb22292250 [1,0,0,0,0,0|1,0,2]=4 208 B12R1.252 CC(O)CCNc1ccccc1 Amb25376877 [1,0,0,0,0,0|1,0,2]=4 209 B12R1.252 CC(S)CNCc1ccccc1 Amb18648551 [1,0,0,0,0,0|1,1,1]=4 210 B12R1.252 CN(C)CCOc1ccccc1 Amb22499767 [1,0,0,0,0,0|3,0,0]=4 211 B12R1.252 CN(CCCc1ccccc1)C Amb1085936 [1,0,0,0,0,0|2,0,0]=3 212 B12R1.252 CN(N)CCNc1ccccc1 Amb18646399 [1,0,0,0,0,0|3,0,0]=4 213 B12R1.252 CN(N)CCOc1ccccc1 Amb18563757 [1,0,0,0,0,0|3,0,0]=4 214 B12R1.252 CS(=O)CCNc1cccc[n]1 Amb24691238 [1,0,0,0,0,0|3,0,0]=4 215 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [1,0,0,0,0,0|2,0,0]=3 216 B12R1.252 CS(=O)NOCc1ccccc1 Amb24620390 [1,0,0,0,0,0|3,0,0]=4 217 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [1,0,0,0,0,0|2,0,1]=4 218 B12R1.252 C[C@@H](N)CCCc1c[n]ccc1 Amb22388607 [1,0,0,0,0,0|2,0,1]=4 219 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [1,0,0,0,0,0|2,0,1]=4 220 B12R1.252 C[C@@H](O)CNCc1ccccc1 Amb25708513 [1,0,0,0,0,0|1,0,2]=4 221 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [1,0,0,0,0,0|1,0,2]=4 222 B12R1.252 C[C@H](N)CNCc1ccccc1 Amb25047295 [1,0,0,0,0,0|2,0,1]=4 223 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [1,0,0,0,0,0|1,0,2]=4 224 B12R1.252 C[SiH](C)CCCc1ccccc1 Amb22366558 [1,0,0,0,0,0|1,1,0]=3 225 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,0|2,0,0]=3 226 B12R1.252 Cl[SiH](Cl)CCCc1ccccc1 Amb22232507 [1,0,0,0,0,0|2,1,0]=4 227 B12R1.252 NC(=N)CCCc1cc[n]cc1 Amb24083112 [1,0,0,0,0,0|3,0,0]=4 228 B12R1.252 NC(=N)CCCc1ccc[n]c1 Amb24062322 [1,0,0,0,0,0|3,0,0]=4 229 B12R1.252 NC(=N)CCCc1cccc[n]1 Amb21618753 [1,0,0,0,0,0|3,0,0]=4 230 B12R1.252 NC(=N)CNCc1ccccc1 Amb25031584 [1,0,0,0,0,0|3,0,0]=4 231 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736089 [1,0,0,0,0,0|3,0,0]=4 232 B12R1.252 NC(=N)NCCc1ccccc1 Amb22736599 [1,0,0,0,0,0|3,0,0]=4 233 B12R1.252 NC(=N)SCCc1ccccc1 Amb20675983 [1,0,0,0,0,0|3,0,0]=4 234 B12R1.252 NC(=O)CCNc1ccc[n]c1 Amb25241565 [1,0,0,0,0,0|3,0,0]=4 235 B12R1.252 NC(=O)CNCc1cccnc1 Amb10609111 [1,0,0,0,0,0|3,0,0]=4 236 B12R1.252 NC(=O)CNCc1cccnc1 Amb1113716 [1,0,0,0,0,0|3,0,0]=4 237 B12R1.252 NC(=O)CNCc1ccncc1 Amb1116176 [1,0,0,0,0,0|3,0,0]=4 238 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [1,0,0,0,0,0|1,0,2]=4 239 B12R1.252 NC(=O)C\N=C\c1ccccc1 Amb24485689 [1,0,0,0,0,0|2,0,1]=4 240 B12R1.252 NC(=O)NCCc1ccc[n]c1 Amb19515015 [1,0,0,0,0,0|3,0,0]=4 241 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,0|2,0,0]=3 242 B12R1.252 NC(=O)NCCc1ccncc1 Amb10553043 [1,0,0,0,0,0|3,0,0]=4 243 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [1,0,0,0,0,0|3,0,0]=4 244 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,0|3,0,0]=4 245 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [1,0,0,0,0,0|1,0,2]=4 246 B12R1.252 NC(=S)CCNc1ccccc1 Amb17233757 [1,0,0,0,0,0|2,1,0]=4 247 B12R1.252 NC(=S)CCSc1ccccc1 Amb17307558 [1,0,0,0,0,0|2,1,0]=4 248 B12R1.252 NC(=S)CNCc1ccccc1 Amb17233758 [1,0,0,0,0,0|2,1,0]=4 249 B12R1.252 NC(=S)NCCc1ccccc1 Amb1647056 [1,0,0,0,0,0|2,1,0]=4 250 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [1,0,0,0,0,0|2,0,0]=3 251 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [1,0,0,0,0,0|1,0,2]=4 252 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [1,0,0,0,0,0|2,0,0]=3 253 B12R1.252 OB(O)CCCc1ccccc1 Amb21928056 [1,0,0,0,0,0|1,0,1]=3 254 B12R1.252 OC(=O)C#CCc1c[n]ccc1 Amb24684542 [1,0,0,0,0,0|1,0,2]=4 255 B12R1.252 OC(=O)C#CCc1cc[n]cc1 Amb25299055 [1,0,0,0,0,0|1,0,2]=4 256 B12R1.252 OC(=O)C#CCc1cccc[n]1 Amb25700659 [1,0,0,0,0,0|1,0,2]=4 257 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [1,0,0,0,0,0|1,0,2]=4 258 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [1,0,0,0,0,0|0,0,3]=4 259 B12R1.252 OC(=O)CC#Cc1c[n]ccc1 Amb25159668 [1,0,0,0,0,0|1,0,2]=4 260 B12R1.252 OC(=O)CC#Cc1cc[n]cc1 Amb24423393 [1,0,0,0,0,0|1,0,2]=4 261 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [1,0,0,0,0,0|0,0,2]=3 262 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [1,0,0,0,0,0|0,0,0]=1 263 B12R1.252 OC(=O)CCCc1[n][n]cc[n]1 Amb18862703 [1,0,0,0,0,0|3,0,0]=4 264 B12R1.252 OC(=O)CCCc1[n]c[n]c[n]1 Amb18862704 [1,0,0,0,0,0|3,0,0]=4 265 B12R1.252 OC(=O)CCCc1[n]ccc[n]1 Amb18862661 [1,0,0,0,0,0|2,0,0]=3 266 B12R1.252 OC(=O)CCCc1c[n]c[n]c1 Amb18827885 [1,0,0,0,0,0|2,0,0]=3 267 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [1,0,0,0,0,0|1,0,0]=2 268 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [1,0,0,0,0,0|1,0,0]=2 269 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,0|0,0,0]=1 270 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [1,0,0,0,0,0|1,0,0]=2 271 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [1,0,0,0,0,0|1,0,0]=2 272 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [1,0,0,0,0,0|1,0,0]=2 273 B12R1.252 OC(=O)CCNc1c[n]c[n]c1 Amb18933238 [1,0,0,0,0,0|3,0,0]=4 274 B12R1.252 OC(=O)CCNc1cc[n]c[n]1 Amb19011486 [1,0,0,0,0,0|3,0,0]=4 275 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [1,0,0,0,0,0|2,0,0]=3 276 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,0|1,0,0]=2 277 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [1,0,0,0,0,0|2,0,0]=3 278 B12R1.252 OC(=O)CCNc1ncccn1 Amb1109664 [1,0,0,0,0,0|3,0,0]=4 279 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,0|1,0,0]=2 280 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,0|1,0,0]=2 281 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [1,0,0,0,0,0|2,0,0]=3 282 B12R1.252 OC(=O)CNCc1c[n]cc[n]1 Amb19030033 [1,0,0,0,0,0|3,0,0]=4 283 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [1,0,0,0,0,0|2,0,0]=3 284 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [1,0,0,0,0,0|2,0,0]=3 285 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [1,0,0,0,0,0|2,0,0]=3 286 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [1,0,0,0,0,0|2,0,0]=3 287 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [1,0,0,0,0,0|2,0,0]=3 288 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,0|2,0,0]=3 289 B12R1.252 OC(=O)CONc1cccc[n]1 Amb24497875 [1,0,0,0,0,0|3,0,0]=4 290 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [1,0,0,0,0,0|2,0,0]=3 291 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [1,0,0,0,0,0|2,0,0]=3 292 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [1,0,0,0,0,0|2,0,0]=3 293 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,0|1,0,0]=2 294 B12R1.252 OC(=O)C\C=C\c1cc[n]cc1 Amb24571194 [1,0,0,0,0,0|1,0,2]=4 295 B12R1.252 OC(=O)C\C=C\c1cccc[n]1 Amb25073201 [1,0,0,0,0,0|1,0,2]=4 296 B12R1.252 OC(=O)C\N=C/c1cc[n]cc1 Amb25273885 [1,0,0,0,0,0|2,0,1]=4 297 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [1,0,0,0,0,0|1,0,1]=3 298 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [1,0,0,0,0,0|1,0,2]=4 299 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [1,0,0,0,0,0|1,0,2]=4 300 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [1,0,0,0,0,0|1,0,2]=4 301 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [1,0,0,0,0,0|1,0,2]=4 302 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [1,0,0,0,0,0|1,0,2]=4 303 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [1,0,0,0,0,0|1,0,1]=3 304 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [1,0,0,0,0,0|2,0,1]=4 305 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [1,0,0,0,0,0|2,0,1]=4 306 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [1,0,0,0,0,0|0,0,1]=2 307 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,0|1,0,1]=3 308 B14R1.13 BrCC(=O)NCCc1ccc(cc1)F Amb17325725 [0,1,0,0,0,0|3,0,0]=4 309 B14R1.13 BrCC(=O)NCCc1ccc(cc1)O Amb17325592 [0,1,0,0,0,0|3,0,0]=4 310 B14R1.13 C#CC(=O)NCCc1ccc(O)cc1 Amb19060335 [0,1,0,0,0,0|2,0,1]=4 311 B14R1.13 CCC(=O)NCCc1ccc(cc1)F Amb1868957 [0,1,0,0,0,0|2,0,0]=3 312 B14R1.13 CCC(=O)NCCc1ccc(cc1)N Amb17139366 [0,1,0,0,0,0|2,0,0]=3 313 B14R1.13 CN=C(NCCc1ccc(cc1)Cl)N Amb11206703 [0,1,0,0,0,0|3,0,0]=4 314 B14R1.13 CNC(=N)NCCc1ccc(F)cc1 Amb19063432 [0,1,0,0,0,0|3,0,0]=4 315 B14R1.13 CNC(=N)NCCc1ccc(O)cc1 Amb19061800 [0,1,0,0,0,0|3,0,0]=4 316 B14R1.13 CNC(=O)CCCc1ccc(cc1)N Amb17336479 [0,1,0,0,0,0|1,0,0]=2 317 B14R1.13 CNC(=O)CCNc1ccc(Br)cc1 Amb24565640 [0,1,0,0,0,0|2,0,0]=3 318 B14R1.13 CNC(=O)CCNc1ccc(Cl)c[n]1 Amb25183118 [0,1,0,0,0,0|3,0,0]=4 319 B14R1.13 CNC(=O)CCNc1ccc(Cl)cc1 Amb24730153 [0,1,0,0,0,0|2,0,0]=3 320 B14R1.13 CNC(=O)CCNc1ccc(F)c[n]1 Amb19082298 [0,1,0,0,0,0|3,0,0]=4 321 B14R1.13 CNC(=O)CCNc1ccc(F)cc1 Amb19064592 [0,1,0,0,0,0|2,0,0]=3 322 B14R1.13 CNC(=O)CCNc1ccc(I)cc1 Amb25361876 [0,1,0,0,0,0|2,0,0]=3 323 B14R1.13 CNC(=O)CCNc1ccc(N)[n]c1 Amb19080037 [0,1,0,0,0,0|3,0,0]=4 324 B14R1.13 CNC(=O)CCNc1ccc(N)c[n]1 Amb19080040 [0,1,0,0,0,0|3,0,0]=4 325 B14R1.13 CNC(=O)CCNc1ccc(N)cc1 Amb19035022 [0,1,0,0,0,0|2,0,0]=3 326 B14R1.13 CNC(=O)CCOc1ccc(N)cc1 Amb18538554 [0,1,0,0,0,0|2,0,0]=3 327 B14R1.13 CNC(=O)CCOc1ccc(cc1)Br Amb17266149 [0,1,0,0,0,0|2,0,0]=3 328 B14R1.13 CNC(=O)CCOc1ccc(cc1)F Amb13891872 [0,1,0,0,0,0|2,0,0]=3 329 B14R1.13 CNC(=O)CCSc1ccc(F)cc1 Amb19338532 [0,1,0,0,0,0|2,0,0]=3 330 B14R1.13 CNC(=O)CCSc1ccc(cc1)C Amb1827981 [0,1,0,0,0,0|2,0,0]=3 331 B14R1.13 CNC(=O)CSCc1ccc(cc1)F Amb2114239 [0,1,0,0,0,0|2,0,0]=3 332 B14R1.13 CNC(=O)CSCc1ccc(cc1)N Amb17498722 [0,1,0,0,0,0|2,0,0]=3 333 B14R1.13 CNC(=O)NCCc1ccc(Br)cc1 Amb24693714 [0,1,0,0,0,0|2,0,0]=3 334 B14R1.13 CNC(=O)NCCc1ccc(cc1)Cl Amb2132770 [0,1,0,0,0,0|2,0,0]=3 335 B14R1.13 CNC(=O)NCCc1ccc(cc1)F Amb2132754 [0,1,0,0,0,0|2,0,0]=3 336 B14R1.13 CNC(=O)NCCc1ccc(cc1)O Amb2132787 [0,1,0,0,0,0|2,0,0]=3 337 B14R1.13 COC(=O)C#CCc1ccc(F)cc1 Amb25067541 [0,1,0,0,0,0|0,0,2]=3 338 B14R1.13 COC(=O)C=CNc1ccc(Br)cc1 Amb22461269 [0,1,0,0,0,0|1,0,2]=4 339 B14R1.13 COC(=O)CCCc1ccc(Br)cc1 Amb18629275 [0,1,0,0,0,0|0,0,0]=1 340 B14R1.13 COC(=O)CCCc1ccc(Cl)cc1 Amb18629276 [0,1,0,0,0,0|0,0,0]=1 341 B14R1.13 COC(=O)CCCc1ccc(F)cc1 Amb18110191 [0,1,0,0,0,0|0,0,0]=1 342 B14R1.13 COC(=O)CCCc1ccc(N)cc1 Amb22728278 [0,1,0,0,0,0|0,0,0]=1 343 B14R1.13 COC(=O)CCNc1ccc(Br)c[n]1 Amb22497987 [0,1,0,0,0,0|2,0,0]=3 344 B14R1.13 COC(=O)CCNc1ccc(cc1)Br Amb1981435 [0,1,0,0,0,0|1,0,0]=2 345 B14R1.13 COC(=O)CCOc1ccc(cc1)N Amb13951735 [0,1,0,0,0,0|1,0,0]=2 346 B14R1.13 COC(=O)CNCc1ccc(cc1)Cl Amb10609077 [0,1,0,0,0,0|1,0,0]=2 347 B14R1.13 COC(=O)NCCc1ccc(Br)cc1 Amb23589074 [0,1,0,0,0,0|1,0,0]=2 348 B14R1.13 COC(=O)N\C=C\c1ccc(O)cc1 Amb24336614 [0,1,0,0,0,0|1,0,2]=4 349 B14R1.13 COC(=O)N\N=C\c1ccc(cc1)Cl Amb1650057 [0,1,0,0,0,0|2,0,1]=4 350 B14R1.13 COC(=O)\C=C\Nc1ccc(Cl)cc1 Amb24375390 [0,1,0,0,0,0|1,0,2]=4 351 B14R1.13 Cc1ccc(CCCC(=O)OC)cc1 Amb18110189 [0,1,0,0,0,0|0,0,0]=1 352 B14R1.13 Cc1ccc(NCCC(=O)NC)[n]c1 Amb19079416 [0,1,0,0,0,0|3,0,0]=4 353 B14R1.13 Cc1ccc(\C=C\NC(=O)OC)cc1 Amb24757598 [0,1,0,0,0,0|1,0,2]=4 354 B14R1.13 Cc1ccc(cc1)NCCC(=O)NC Amb19078978 [0,1,0,0,0,0|2,0,0]=3 355 B14R1.13 Cc1ccc(cc1)NCCC(=O)NO Amb25116380 [0,1,0,0,0,0|3,0,0]=4 356 B14R1.13 ClCC(=O)NCCc1ccc(cc1)Br Amb17421889 [0,1,0,0,0,0|3,0,0]=4 357 B14R1.13 ClCC(=O)NCCc1ccc(cc1)C Amb10075558 [0,1,0,0,0,0|3,0,0]=4 358 B14R1.13 ClCC(=O)NCCc1ccc(cc1)F Amb1635500 [0,1,0,0,0,0|3,0,0]=4 359 B14R1.13 NCC(=O)NCCc1ccc(Cl)cc1 Amb24770025 [0,1,0,0,0,0|3,0,0]=4 360 B14R1.13 NCC(=O)NCCc1ccc(cc1)Br Amb17414922 [0,1,0,0,0,0|3,0,0]=4 361 B14R1.13 NCC(=O)NCCc1ccc(cc1)C Amb17401668 [0,1,0,0,0,0|3,0,0]=4 362 B14R1.13 NNC(=O)CCCc1ccc(cc1)O Amb1822852 [0,1,0,0,0,0|2,0,0]=3 363 B14R1.13 NNC(=O)CCNc1ccc(cc1)Br Amb17605078 [0,1,0,0,0,0|3,0,0]=4 364 B14R1.13 NNC(=O)CCNc1ccc(cc1)C Amb17605080 [0,1,0,0,0,0|3,0,0]=4 365 B14R1.13 NNC(=O)CCNc1ccc(cc1)Cl Amb17605073 [0,1,0,0,0,0|3,0,0]=4 366 B14R1.13 NNC(=O)CCNc1ccc(cc1)F Amb17605075 [0,1,0,0,0,0|3,0,0]=4 367 B14R1.13 NNC(=O)CCSc1ccc(cc1)C Amb1105982 [0,1,0,0,0,0|3,0,0]=4 368 B14R1.13 NNC(=O)NCCc1ccc(Br)cc1 Amb25738164 [0,1,0,0,0,0|3,0,0]=4 369 B14R1.13 NNC(=O)NCCc1ccc(Cl)cc1 Amb25302908 [0,1,0,0,0,0|3,0,0]=4 370 B14R1.13 NNC(=O)NCCc1ccc(O)cc1 Amb19042965 [0,1,0,0,0,0|3,0,0]=4 371 B14R1.13 OCC(=O)NCCc1ccc(cc1)Br Amb17415250 [0,1,0,0,0,0|3,0,0]=4 372 B14R1.13 OCC(=O)NCCc1ccc(cc1)C Amb17401775 [0,1,0,0,0,0|3,0,0]=4 373 B14R1.13 OCC(=O)NCCc1ccc(cc1)Cl Amb1110300 [0,1,0,0,0,0|3,0,0]=4 374 B14R1.13 OCC(=O)NCCc1ccc(cc1)F Amb1109713 [0,1,0,0,0,0|3,0,0]=4 375 B14R1.163 BrCC(=O)NCC(c1ccccc1)O Amb17332028 [0,1,0,0,0,0|3,0,0]=4 376 B14R1.163 C#CC(=O)NCC(N)c1ccccc1 Amb24442445 [0,1,0,0,0,0|2,0,1]=4 377 B14R1.163 CCC(=O)CNC(=O)c1ccccc1 Amb23555724 [0,1,0,0,0,0|2,0,1]=4 378 B14R1.163 CCC(=O)NCC(=O)c1ccccc1 Amb17336295 [0,1,0,0,0,0|2,0,1]=4 379 B14R1.163 CNC(=N)NCC(O)c1ccccc1 Amb19061797 [0,1,0,0,0,0|3,0,0]=4 380 B14R1.163 CNC(=O)CCC(=O)c1ccccc1 Amb17336307 [0,1,0,0,0,0|1,0,1]=3 381 B14R1.163 CNC(=O)CCC(=O)c1cccnc1 Amb17617716 [0,1,0,0,0,0|2,0,1]=4 382 B14R1.163 CNC(=O)CCC(c1ccccc1)O Amb17336618 [0,1,0,0,0,0|1,0,0]=2 383 B14R1.163 CNC(=O)CNC(=N)c1ccccc1 Amb24677147 [0,1,0,0,0,0|2,0,1]=4 384 B14R1.163 CNC(=O)CNC(=O)c1ccccc1 Amb1666156 [0,1,0,0,0,0|2,0,1]=4 385 B14R1.163 CNC(=O)CSC(C)c1ccccc1 Amb21620817 [0,1,0,0,0,0|2,0,0]=3 386 B14R1.163 CNC(=O)NCC(=O)c1ccccc1 Amb24639111 [0,1,0,0,0,0|2,0,1]=4 387 B14R1.163 CNC(=O)NCC(C)c1ccccc1 Amb25143591 [0,1,0,0,0,0|2,0,0]=3 388 B14R1.163 CNC(=O)NCC(N)c1ccccc1 Amb25048042 [0,1,0,0,0,0|2,0,0]=3 389 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,1,0,0,0,0|2,0,0]=3 390 B14R1.163 CNC(=S)NCC(C)c1ccccc1 Amb24380520 [0,1,0,0,0,0|2,1,0]=4 391 B14R1.163 COC(=O)C#CC(C)c1ccccc1 Amb24461465 [0,1,0,0,0,0|0,0,2]=3 392 B14R1.163 COC(=O)C#CC(O)c1ccccc1 Amb25796421 [0,1,0,0,0,0|0,0,2]=3 393 B14R1.163 COC(=O)C#C[C@H](O)c1ccccc1 Amb25079187 [0,1,0,0,0,0|0,0,2]=3 394 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb19373309 [0,1,0,0,0,0|0,0,0]=1 395 B14R1.163 COC(=O)CCC(c1ccccc1)N Amb10610596 [0,1,0,0,0,0|0,0,0]=1 396 B14R1.163 COC(=O)CNC(=O)c1ccccc1 Amb1006962 [0,1,0,0,0,0|1,0,1]=3 397 B14R1.163 COC(=O)CNC(=O)c1ccncc1 Amb2214174 [0,1,0,0,0,0|2,0,1]=4 398 B14R1.163 COC(=O)CNC(=S)c1ccccc1 Amb22495668 [0,1,0,0,0,0|1,0,1]=3 399 B14R1.163 COC(=O)\C=C\C(=O)c1ccccc1 Amb2435415 [0,1,0,0,0,0|0,0,3]=4 400 B14R1.163 COC(C)CCC(=O)c1ccccc1 Amb22229823 [0,1,0,0,0,0|1,0,2]=4 401 B14R1.163 ClCC(=O)NCC(c1ccccc1)C Amb1657748 [0,1,0,0,0,0|3,0,0]=4 402 B14R1.163 ClCC(=O)NCC(c1ccccc1)O Amb17326215 [0,1,0,0,0,0|3,0,0]=4 403 B14R1.163 NNC(=O)CCC(c1ccccc1)O Amb1808301 [0,1,0,0,0,0|2,0,0]=3 404 B14R1.163 O=C(NCC(=O)O[Na])c1ccccc1 Amb22349455 [0,1,0,0,0,0|2,0,1]=4 405 B14R1.163 OCC(=O)NCC(c1ccccc1)C Amb1110526 [0,1,0,0,0,0|3,0,0]=4 406 B14R1.292 CCP(O)(=O)CNCc1ccccc1 Amb24444866 [0,1,0,0,0,0|3,0,0]=4 407 B14R1.292 O=S(=O)(CCl)CCCc1ccccc1 Amb22364591 [0,1,0,0,0,0|3,0,0]=4 408 B14R1.520 BrCCC(=O)NCCc1ccccn1 Amb17329338 [0,1,0,0,0,0|3,0,0]=4 409 B14R1.520 CC#CC(=O)NOCc1ccccc1 Amb24382783 [0,1,0,0,0,0|3,0,0]=4 410 B14R1.520 CCCC(=C)CNCc1ccccc1 Amb24498173 [0,1,0,0,0,0|3,0,0]=4 411 B14R1.520 CCCC(=O)CCCc1ccccc1 Amb17234943 [0,1,0,0,0,0|1,0,0]=2 412 B14R1.520 CCCC(=O)CCCc1cccnc1 Amb17235104 [0,1,0,0,0,0|2,0,0]=3 413 B14R1.520 CCCC(=O)COCc1ccccc1 Amb19078959 [0,1,0,0,0,0|2,0,0]=3 414 B14R1.520 CCCC(=O)NOCc1ccccc1 Amb15742562 [0,1,0,0,0,0|3,0,0]=4 415 B14R1.520 CCNC(=O)COCc1ccccc1 Amb24386300 [0,1,0,0,0,0|2,0,0]=3 416 B14R1.520 CCNC(=O)NOCc1ccccc1 Amb22460726 [0,1,0,0,0,0|3,0,0]=4 417 B14R1.520 CCOC(=C)CNCc1ccccc1 Amb24374594 [0,1,0,0,0,0|2,0,0]=3 418 B14R1.520 CCOC(=N)CCCc1cc[n]cc1 Amb24083113 [0,1,0,0,0,0|2,0,0]=3 419 B14R1.520 CCOC(=N)CCCc1ccc[n]c1 Amb24066215 [0,1,0,0,0,0|2,0,0]=3 420 B14R1.520 CCOC(=N)CCCc1cccc[n]1 Amb24083111 [0,1,0,0,0,0|2,0,0]=3 421 B14R1.520 CCOC(=O)C#CCc1c[n]ccc1 Amb24377300 [0,1,0,0,0,0|1,0,2]=4 422 B14R1.520 CCOC(=O)C#CCc1cc[n]cc1 Amb25364795 [0,1,0,0,0,0|1,0,2]=4 423 B14R1.520 CCOC(=O)CCNc1ccccc1 Amb21961618 [0,1,0,0,0,0|1,0,0]=2 424 B14R1.520 CCOC(=O)CNCc1ccccc1 Amb20247257 [0,1,0,0,0,0|1,0,0]=2 425 B14R1.520 CCOC(=O)CNNc1ccccc1 Amb2228018 [0,1,0,0,0,0|2,0,0]=3 426 B14R1.520 CCOC(=O)NN=Cc1ccccc1 Amb24103594 [0,1,0,0,0,0|2,0,1]=4 427 B14R1.520 CCOC(=O)NNCc1ccccc1 Amb25183830 [0,1,0,0,0,0|2,0,0]=3 428 B14R1.520 CCOC(=O)N\C=C\c1ccccc1 Amb19987022 [0,1,0,0,0,0|1,0,2]=4 429 B14R1.520 CCOC(=O)ONNc1ccccc1 Amb22438848 [0,1,0,0,0,0|3,0,0]=4 430 B14R1.520 CCOC(=O)\C=C\Cc1ccccc1 Amb10873144 [0,1,0,0,0,0|0,0,2]=3 431 B14R1.520 CCOC(=O)\C=C\Nc1ccccc1 Amb24563491 [0,1,0,0,0,0|1,0,2]=4 432 B14R1.520 CCOC(C)CNCc1ccccc1 Amb24499583 [0,1,0,0,0,0|2,0,1]=4 433 B14R1.520 CNCC(=O)NCCc1ccccc1 Amb15740954 [0,1,0,0,0,0|2,0,0]=3 434 B14R1.520 CNCC(=O)NOCc1ccccc1 Amb25335308 [0,1,0,0,0,0|3,0,0]=4 435 B14R1.520 COCC(=O)NCCc1ccccn1 Amb10668889 [0,1,0,0,0,0|2,0,0]=3 436 B14R1.520 COCC(=O)NCCc1cccnc1 Amb15746996 [0,1,0,0,0,0|2,0,0]=3 437 B14R1.520 COCC(=O)NOCc1ccccc1 Amb10682506 [0,1,0,0,0,0|2,0,0]=3 438 B14R1.520 COCC(C)CNCc1ccccc1 Amb19079604 [0,1,0,0,0,0|2,0,1]=4 439 B14R1.520 COCC(N)CNCc1ccccc1 Amb24693699 [0,1,0,0,0,0|2,0,1]=4 440 B14R1.520 COCC(O)COCc1ccccc1 Amb25736726 [0,1,0,0,0,0|1,0,2]=4 441 B14R1.520 COCC(S)CNCc1ccccc1 Amb25315102 [0,1,0,0,0,0|1,1,1]=4 442 B14R1.520 COC[C@H](CNCc1ccccc1)O Amb10067148 [0,1,0,0,0,0|1,0,2]=4 443 B14R1.520 CSCC(=O)NCCc1ccccc1 Amb19419141 [0,1,0,0,0,0|1,1,0]=3 444 B14R1.520 CSCC(=O)NCCc1ccccn1 Amb13958069 [0,1,0,0,0,0|2,1,0]=4 445 B14R1.520 CSCC(=O)NOCc1ccccc1 Amb21388015 [0,1,0,0,0,0|2,1,0]=4 446 B14R1.520 C\C(\CNCc1ccccc1)=C\CC Amb25337800 [0,1,0,0,0,0|3,0,0]=4 447 B14R1.520 ClCCC(=O)NCCc1ccccc1 Amb1132002 [0,1,0,0,0,0|2,0,0]=3 448 B14R1.520 ClCCC(=O)NCCc1ccncc1 Amb17329185 [0,1,0,0,0,0|3,0,0]=4 449 B14R1.520 ClCCN(CCCc1ccccc1)C Amb17339772 [0,1,0,0,0,0|3,0,0]=4 450 B14R1.520 N#CCC(=O)OCCc1ccccc1 Amb17210534 [0,1,0,0,0,0|2,0,1]=4 451 B14R1.520 NCCC(=O)CNCc1ccccc1 Amb25200064 [0,1,0,0,0,0|2,0,0]=3 452 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb1131212 [0,1,0,0,0,0|2,0,0]=3 453 B14R1.520 NCCC(=O)NCCc1ccccc1 Amb15741009 [0,1,0,0,0,0|2,0,0]=3 454 B14R1.520 O=C(CCBr)NOCc1ccccc1 Amb24412294 [0,1,0,0,0,0|3,0,0]=4 455 B14R1.520 O=C=NC(=O)CCOc1ccccc1 Amb17235024 [0,1,0,0,0,0|2,0,1]=4 456 B14R1.520 OCCN(CCCc1ccccc1)C Amb17336738 [0,1,0,0,0,0|3,0,0]=4 457 B14R1.546 CC[C@@H](COCc1ccccc1)C=O Amb25122616 [0,1,0,0,0,0|2,0,1]=4 458 B14R1.546 CN\C(\NCCc1ccccc1)=N\C Amb24710194 [0,1,0,0,0,0|3,0,0]=4 459 B14R1.546 CN\C(\NCCc1ccccc1)=N\N Amb25121072 [0,1,0,0,0,0|3,0,0]=4 460 B14R1.546 COC(CCCc1ccccc1)OC Amb10559986 [0,1,0,0,0,0|0,0,2]=3 461 B14R1.546 COC(CNCc1ccccc1)OC Amb22274219 [0,1,0,0,0,0|1,0,2]=4 462 B14R1.546 COC(COCc1ccccc1)CN Amb24559882 [0,1,0,0,0,0|2,0,1]=4 463 B14R1.546 COC(COCc1ccccc1)OC Amb10807987 [0,1,0,0,0,0|1,0,2]=4 464 B14R1.546 CO[C@@H](COCc1ccccc1)CO Amb25316044 [0,1,0,0,0,0|1,0,2]=4 465 B14R1.546 CO[C@H](COCc1ccccc1)C=O Amb25370646 [0,1,0,0,0,0|1,0,1]=3 466 B14R1.743 BrCC(=O)NC(Cc1ccccc1)C Amb17333679 [0,1,0,0,0,0|3,0,0]=4 467 B14R1.743 CC(Cc1ccccc1)NC(=O)CN Amb19036468 [0,1,0,0,0,0|3,0,0]=4 468 B14R1.743 CC(Cc1ccccc1)NC(=O)NN Amb19042175 [0,1,0,0,0,0|3,0,0]=4 469 B14R1.743 CCC(=O)CN(C)Cc1ccccc1 Amb19078626 [0,1,0,0,0,0|2,0,0]=3 470 B14R1.743 CCC(=O)NC(=O)Cc1ccccc1 Amb10563533 [0,1,0,0,0,0|2,0,1]=4 471 B14R1.743 CN(Cc1ccccc1)CC(=O)NN Amb19651325 [0,1,0,0,0,0|3,0,0]=4 472 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [0,1,0,0,0,0|3,0,0]=4 473 B14R1.743 CNC(=O)CC(=O)Nc1ccccc1 Amb24506382 [0,1,0,0,0,0|2,0,1]=4 474 B14R1.743 CNC(=O)CC(C)Nc1cccc[n]1 Amb24337804 [0,1,0,0,0,0|3,0,0]=4 475 B14R1.743 CNC(=O)CC(C)Nc1ccccc1 Amb25283916 [0,1,0,0,0,0|2,0,0]=3 476 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 Amb19967610 [0,1,0,0,0,0|2,0,0]=3 477 B14R1.743 CNC(=O)NC(C)Cc1ccccc1 Amb25277231 [0,1,0,0,0,0|2,0,0]=3 478 B14R1.743 CNC(=S)NC(C)Cc1ccccc1 Amb25678616 [0,1,0,0,0,0|2,1,0]=4 479 B14R1.743 COC(=N)NC(=O)Cc1ccccc1 Amb25686037 [0,1,0,0,0,0|2,0,1]=4 480 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,0|0,0,0]=1 481 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,0|0,0,0]=1 482 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,0|0,0,0]=1 483 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,0|0,0,0]=1 484 B14R1.743 COC(=O)NC(=N)Nc1ccccc1 Amb25338054 [0,1,0,0,0,0|2,0,1]=4 485 B14R1.743 COC(=O)\C=C(/Nc1ccccc1)\C Amb2386652 [0,1,0,0,0,0|1,0,2]=4 486 B14R1.743 COC(=O)\C=C(\N)/Nc1ccccc1 Amb25843964 [0,1,0,0,0,0|1,0,2]=4 487 B14R1.756 CC(CNc1ccccc1)C(=O)NN Amb25377013 [0,1,0,0,0,0|3,0,0]=4 488 B14R1.756 CCC(=O)C(C)OCc1ccccc1 Amb25708039 [0,1,0,0,0,0|2,0,0]=3 489 B14R1.756 CCC(=O)N(CCc1ccccc1)C Amb14001759 [0,1,0,0,0,0|2,0,0]=3 490 B14R1.756 CNC(=O)C(=O)CCc1c[n]ccc1 Amb22734372 [0,1,0,0,0,0|2,0,1]=4 491 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 Amb2422863 [0,1,0,0,0,0|2,0,1]=4 492 B14R1.756 CNC(=O)C(O)CNc1cccc[n]1 Amb25795271 [0,1,0,0,0,0|3,0,0]=4 493 B14R1.756 CNC(=O)C(O)\C=C\c1ccccc1 Amb25243537 [0,1,0,0,0,0|1,0,2]=4 494 B14R1.756 CNC(=O)C(\C=C\c1ccccc1)C Amb10559934 [0,1,0,0,0,0|1,0,2]=4 495 B14R1.756 CNC(=O)N(Cl)OCc1ccccc1 Amb24658346 [0,1,0,0,0,0|3,0,0]=4 496 B14R1.756 CNC(=O)[C@@H](C)NCc1ccccc1 Amb25819693 [0,1,0,0,0,0|2,0,0]=3 497 B14R1.756 CNC(=O)[C@H](C)NCc1ccccc1 Amb25819451 [0,1,0,0,0,0|2,0,0]=3 498 B14R1.756 COC(=O)C(=O)CCc1ccccc1 Amb10069228 [0,1,0,0,0,0|0,0,1]=2 499 B14R1.756 COC(=O)C(=O)NCc1ccccc1 Amb24444903 [0,1,0,0,0,0|1,0,1]=3 500 B14R1.756 COC(=O)C(Br)CCc1ccccc1 Amb22500039 [0,1,0,0,0,0|0,0,0]=1 501 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,0|0,0,0]=1 502 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,0|1,0,0]=2 503 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,0|1,0,0]=2 504 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,0|0,0,0]=1 505 B14R1.756 COC(=O)C(\N=C\c1ccccc1)C Amb2426902 [0,1,0,0,0,0|1,0,1]=3 506 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,0|1,0,0]=2 507 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb23439002 [0,1,0,0,0,0|0,0,0]=1 508 B14R1.756 COC(=O)[C@H](C)OCc1ccccc1 Amb25833053 [0,1,0,0,0,0|1,0,0]=2 509 B14R1.756 COC(=O)[C@H](NCc1ccccc1)C Amb16183003 [0,1,0,0,0,0|1,0,0]=2 510 B14R1.756 COC(=O)[C@H](O)C#Cc1ccccc1 Amb25687820 [0,1,0,0,0,0|0,0,2]=3 511 B14R1.756 COC(=O)[C@H](OCc1ccccc1)C Amb17617220 [0,1,0,0,0,0|1,0,0]=2 512 B14R1.756 COC(=O)\C(\Cl)=N\Nc1ccccc1 Amb24277024 [0,1,0,0,0,0|2,0,1]=4 513 B14R1.756 C[C@@H](OCc1ccccc1)C(=O)NN Amb25242729 [0,1,0,0,0,0|3,0,0]=4 514 B14R1.756 C\C(=N\Nc1ccccc1)\C(=O)OC Amb22551092 [0,1,0,0,0,0|2,0,1]=4 515 B14R1.756 ClCC(=O)N(CCc1ccccc1)C Amb17241042 [0,1,0,0,0,0|3,0,0]=4 516 B14R1.756 NCC(=O)N(CCc1ccccc1)C Amb17235470 [0,1,0,0,0,0|3,0,0]=4 517 B14R1.756 OCC(=O)N(CCc1ccccc1)C Amb17401768 [0,1,0,0,0,0|3,0,0]=4 518 B14R1.837 BrCC(=O)NCCc1ccccc1C Amb17331119 [0,1,0,0,0,0|3,0,0]=4 519 B14R1.837 CCC(=O)NCCc1ccccc1Br Amb13133639 [0,1,0,0,0,0|2,0,0]=3 520 B14R1.837 CCC(=O)NCCc1ccccc1C Amb10672003 [0,1,0,0,0,0|2,0,0]=3 521 B14R1.837 CNC(=N)NCCc1ccccc1F Amb19063433 [0,1,0,0,0,0|3,0,0]=4 522 B14R1.837 CNC(=O)CCNc1[n]cccc1Br Amb25797957 [0,1,0,0,0,0|3,0,0]=4 523 B14R1.837 CNC(=O)CCNc1[n]cccc1Cl Amb25115499 [0,1,0,0,0,0|3,0,0]=4 524 B14R1.837 CNC(=O)CCNc1[n]cccc1F Amb19029665 [0,1,0,0,0,0|3,0,0]=4 525 B14R1.837 CNC(=O)CCNc1[n]cccc1N Amb19080039 [0,1,0,0,0,0|3,0,0]=4 526 B14R1.837 CNC(=O)CCNc1cc[n]cc1N Amb19080038 [0,1,0,0,0,0|3,0,0]=4 527 B14R1.837 CNC(=O)CCNc1ccccc1Br Amb24454929 [0,1,0,0,0,0|2,0,0]=3 528 B14R1.837 CNC(=O)CCNc1ccccc1F Amb19064593 [0,1,0,0,0,0|2,0,0]=3 529 B14R1.837 CNC(=O)CCNc1ccccc1I Amb25663743 [0,1,0,0,0,0|2,0,0]=3 530 B14R1.837 CNC(=O)CCNc1ccccc1N Amb19079422 [0,1,0,0,0,0|2,0,0]=3 531 B14R1.837 CNC(=O)CCOc1ccccc1Br Amb17266147 [0,1,0,0,0,0|2,0,0]=3 532 B14R1.837 CNC(=O)CCOc1ccccc1N Amb17235928 [0,1,0,0,0,0|2,0,0]=3 533 B14R1.837 CNC(=O)CCSc1ccccc1Br Amb19345121 [0,1,0,0,0,0|2,0,0]=3 534 B14R1.837 CNC(=O)CCSc1ccccc1F Amb19422943 [0,1,0,0,0,0|2,0,0]=3 535 B14R1.837 CNC(=O)CSCc1ccccc1Cl Amb21799001 [0,1,0,0,0,0|2,0,0]=3 536 B14R1.837 CNC(=O)NCCc1ccccc1Br Amb13047212 [0,1,0,0,0,0|2,0,0]=3 537 B14R1.837 COC(=O)C#CCc1ccccc1F Amb25338856 [0,1,0,0,0,0|0,0,2]=3 538 B14R1.837 COC(=O)CCCN1C=CC=CC1=O Amb19080573 [0,1,0,0,0,0|1,0,0]=2 539 B14R1.837 COC(=O)CCNc1[n]cccc1Cl Amb22497988 [0,1,0,0,0,0|2,0,0]=3 540 B14R1.837 COC(=O)CCNc1ccc[n]c1Cl Amb18095536 [0,1,0,0,0,0|2,0,0]=3 541 B14R1.837 COC(=O)CCOc1ccccc1N Amb19148869 [0,1,0,0,0,0|1,0,0]=2 542 B14R1.837 COC(=O)CCSc1ccccc1N Amb22461590 [0,1,0,0,0,0|1,0,0]=2 543 B14R1.837 COC(=O)CNCc1ccccc1C Amb10610000 [0,1,0,0,0,0|1,0,0]=2 544 B14R1.837 COC(=O)CNCc1ccccc1Cl Amb10609298 [0,1,0,0,0,0|1,0,0]=2 545 B14R1.837 COC(=O)NCCc1ccccc1Br Amb22831370 [0,1,0,0,0,0|1,0,0]=2 546 B14R1.837 COC(=O)NCCc1ccccc1N Amb17777450 [0,1,0,0,0,0|1,0,0]=2 547 B14R1.837 COC(=O)NSNc1ccccc1N Amb25240068 [0,1,0,0,0,0|3,0,0]=4 548 B14R1.837 COC(=O)N\C=C\c1ccccc1O Amb24523801 [0,1,0,0,0,0|1,0,2]=4 549 B14R1.837 COC(=O)N\N=C\c1ccccc1Br Amb1210788 [0,1,0,0,0,0|2,0,1]=4 550 B14R1.837 COC(=O)N\N=C\c1ccccc1Cl Amb2411285 [0,1,0,0,0,0|2,0,1]=4 551 B14R1.837 COC(=O)\C=C/Nc1ccccc1O Amb18651395 [0,1,0,0,0,0|1,0,2]=4 552 B14R1.837 COC(=O)\C=C\Nc1ccccc1Br Amb25229830 [0,1,0,0,0,0|1,0,2]=4 553 B14R1.837 COC(=O)\C=C\Nc1ccccc1F Amb25315731 [0,1,0,0,0,0|1,0,2]=4 554 B14R1.837 COC(=O)\C=C\Nc1ccccc1I Amb24447872 [0,1,0,0,0,0|1,0,2]=4 555 B14R1.837 COC(=O)\C=C\Nc1ccccc1N Amb18651164 [0,1,0,0,0,0|1,0,2]=4 556 B14R1.837 COC(=O)\C=C\Nc1ccccc1O Amb25238758 [0,1,0,0,0,0|1,0,2]=4 557 B14R1.837 Cc1c[n]ccc1NCCC(=O)NC Amb24335900 [0,1,0,0,0,0|3,0,0]=4 558 B14R1.837 Cc1ccc[n]c1NCCC(=O)NC Amb18330390 [0,1,0,0,0,0|3,0,0]=4 559 B14R1.837 Cc1ccccc1CCNC(=O)NC Amb25272370 [0,1,0,0,0,0|2,0,0]=3 560 B14R1.837 Cc1ccccc1CCNC(=S)NC Amb25221284 [0,1,0,0,0,0|2,1,0]=4 561 B14R1.837 Cc1ccccc1NCCC(=O)NC Amb19078979 [0,1,0,0,0,0|2,0,0]=3 562 B14R1.837 Cc1ccccc1NCCC(=O)NN Amb24531293 [0,1,0,0,0,0|3,0,0]=4 563 B14R1.837 ClCC(=O)NCCc1ccccc1C Amb1677630 [0,1,0,0,0,0|3,0,0]=4 564 B14R1.837 ClCC(=O)NCCc1ccccc1Cl Amb17407824 [0,1,0,0,0,0|3,0,0]=4 565 B14R1.837 NCC(=O)NCCc1ccccc1C Amb17401666 [0,1,0,0,0,0|3,0,0]=4 566 B14R1.837 NCC(=O)NCCc1ccccc1Cl Amb17404214 [0,1,0,0,0,0|3,0,0]=4 567 B14R1.837 NNC(=O)NCCc1ccccc1Cl Amb24336508 [0,1,0,0,0,0|3,0,0]=4 568 B14R1.837 OCC(=O)NCCc1ccccc1C Amb17401770 [0,1,0,0,0,0|3,0,0]=4 569 B14R1.837 OCC(=O)NCCc1ccccc1Cl Amb17404293 [0,1,0,0,0,0|3,0,0]=4 570 B14R1.837 OCC(=O)NCCc1ccccc1F Amb17402182 [0,1,0,0,0,0|3,0,0]=4 571 B14R1.1025 C#CC(=O)NCCc1cccc(Br)c1 Amb25322459 [0,1,0,0,0,0|2,0,1]=4 572 B14R1.1025 CCC(=O)NCCc1cccc(c1)F Amb13968706 [0,1,0,0,0,0|2,0,0]=3 573 B14R1.1025 CNC(=N)NCCc1cc(Br)ccc1 Amb24339585 [0,1,0,0,0,0|3,0,0]=4 574 B14R1.1025 CNC(=N)NCCc1cc(F)ccc1 Amb19063434 [0,1,0,0,0,0|3,0,0]=4 575 B14R1.1025 CNC(=O)CCCc1cccc(c1)N Amb17336480 [0,1,0,0,0,0|1,0,0]=2 576 B14R1.1025 CNC(=O)CCNc1cc(Cl)[n]cc1 Amb25671809 [0,1,0,0,0,0|3,0,0]=4 577 B14R1.1025 CNC(=O)CCNc1cc(Cl)ccc1 Amb24335723 [0,1,0,0,0,0|2,0,0]=3 578 B14R1.1025 CNC(=O)CCNc1cc(F)ccc1 Amb19064591 [0,1,0,0,0,0|2,0,0]=3 579 B14R1.1025 CNC(=O)CCNc1cc(I)ccc1 Amb25663742 [0,1,0,0,0,0|2,0,0]=3 580 B14R1.1025 CNC(=O)CCNc1cc(N)[n]cc1 Amb25293645 [0,1,0,0,0,0|3,0,0]=4 581 B14R1.1025 CNC(=O)CCNc1cc(N)cc[n]1 Amb19080041 [0,1,0,0,0,0|3,0,0]=4 582 B14R1.1025 CNC(=O)CCNc1cc(N)ccc1 Amb19079410 [0,1,0,0,0,0|2,0,0]=3 583 B14R1.1025 CNC(=O)CCNc1cccc(Br)[n]1 Amb25757062 [0,1,0,0,0,0|3,0,0]=4 584 B14R1.1025 CNC(=O)CCNc1cccc(F)[n]1 Amb19082300 [0,1,0,0,0,0|3,0,0]=4 585 B14R1.1025 CNC(=O)CCOc1cccc(c1)Br Amb17266148 [0,1,0,0,0,0|2,0,0]=3 586 B14R1.1025 CNC(=O)CCOc1cccc(c1)N Amb17235929 [0,1,0,0,0,0|2,0,0]=3 587 B14R1.1025 CNC(=O)COCc1cccc(N)c1 Amb23569205 [0,1,0,0,0,0|2,0,0]=3 588 B14R1.1025 CNC(=O)CSCc1cccc(c1)Cl Amb10667899 [0,1,0,0,0,0|2,0,0]=3 589 B14R1.1025 CNC(=O)NCCc1cc(Br)ccc1 Amb25375227 [0,1,0,0,0,0|2,0,0]=3 590 B14R1.1025 CNC(=O)NCCc1cc(F)ccc1 Amb25257022 [0,1,0,0,0,0|2,0,0]=3 591 B14R1.1025 CNC(=O)NCCc1cc(N)ccc1 Amb25205557 [0,1,0,0,0,0|2,0,0]=3 592 B14R1.1025 CNC(=S)NCCc1cc(Br)ccc1 Amb24339588 [0,1,0,0,0,0|2,1,0]=4 593 B14R1.1025 CNC(=S)NCCc1cc(F)ccc1 Amb25748399 [0,1,0,0,0,0|2,1,0]=4 594 B14R1.1025 COC(=O)C=CCc1cccc(Cl)c1 Amb22229468 [0,1,0,0,0,0|0,0,2]=3 595 B14R1.1025 COC(=O)CCOC1=CC(=O)NN=C1 Amb22301614 [0,1,0,0,0,0|3,0,0]=4 596 B14R1.1025 COC(=O)CCOc1cc(Cl)[n][n]c1 Amb22301582 [0,1,0,0,0,0|3,0,0]=4 597 B14R1.1025 COC(=O)CCOc1cc(Cl)cc[n]1 Amb22301620 [0,1,0,0,0,0|2,0,0]=3 598 B14R1.1025 COC(=O)CCSc1cc(Cl)cc[n]1 Amb22301623 [0,1,0,0,0,0|2,0,0]=3 599 B14R1.1025 COC(=O)CCSc1cccc(N)c1 Amb22058830 [0,1,0,0,0,0|1,0,0]=2 600 B14R1.1025 COC(=O)CNCc1cccc(c1)F Amb10609869 [0,1,0,0,0,0|1,0,0]=2 601 B14R1.1025 COC(=O)COCc1cccc(N)c1 Amb23443790 [0,1,0,0,0,0|1,0,0]=2 602 B14R1.1025 COC(=O)NCCc1cccc(O)c1 Amb22395729 [0,1,0,0,0,0|1,0,0]=2 603 B14R1.1025 COC(=O)N\N=C/c1cccc(c1)O Amb2438471 [0,1,0,0,0,0|2,0,1]=4 604 B14R1.1025 COC(=O)\C=C\Nc1cccc(Br)c1 Amb25353092 [0,1,0,0,0,0|1,0,2]=4 605 B14R1.1025 COC(=O)\C=C\Nc1cccc(Cl)c1 Amb22434469 [0,1,0,0,0,0|1,0,2]=4 606 B14R1.1025 Cc1c[n]cc(CSCC(=O)NC)c1 Amb24306572 [0,1,0,0,0,0|3,0,0]=4 607 B14R1.1025 Cc1cc(CCNC(=N)NC)ccc1 Amb19073518 [0,1,0,0,0,0|3,0,0]=4 608 B14R1.1025 Cc1cc(CCNC(=O)NC)ccc1 Amb24447971 [0,1,0,0,0,0|2,0,0]=3 609 B14R1.1025 Cc1cc(CCNC(=O)NN)ccc1 Amb19061784 [0,1,0,0,0,0|3,0,0]=4 610 B14R1.1025 Cc1cc(CCNC(=S)NC)ccc1 Amb24457215 [0,1,0,0,0,0|2,1,0]=4 611 B14R1.1025 Cc1cc(CSCC(=O)NC)ccc1 Amb21128708 [0,1,0,0,0,0|2,0,0]=3 612 B14R1.1025 Cc1cc(ccc1)NCCC(=O)NC Amb19074017 [0,1,0,0,0,0|2,0,0]=3 613 B14R1.1025 Cc1cc[n]c(c1)NCCC(=O)NC Amb19079415 [0,1,0,0,0,0|3,0,0]=4 614 B14R1.1025 Cc1cccc(NCCC(=O)NC)[n]1 Amb19079414 [0,1,0,0,0,0|3,0,0]=4 615 B14R1.1025 Cc1cccc(NCCC(=O)OC)[n]1 Amb19051545 [0,1,0,0,0,0|2,0,0]=3 616 B14R1.1025 ClCC(=O)NCCc1cccc(c1)Br Amb17421888 [0,1,0,0,0,0|3,0,0]=4 617 B14R1.1025 ClCC(=O)NCCc1cccc(c1)C Amb17322980 [0,1,0,0,0,0|3,0,0]=4 618 B14R1.1025 ClCC(=O)NCCc1cccc(c1)Cl Amb1676616 [0,1,0,0,0,0|3,0,0]=4 619 B14R1.1025 NCC(=O)NCCc1cccc(c1)Br Amb17414918 [0,1,0,0,0,0|3,0,0]=4 620 B14R1.1025 NCC(=O)NCCc1cccc(c1)C Amb17401667 [0,1,0,0,0,0|3,0,0]=4 621 B14R1.1025 NNC(=O)CCNc1cccc(c1)Br Amb17605077 [0,1,0,0,0,0|3,0,0]=4 622 B14R1.1025 NNC(=O)CCNc1cccc(c1)C Amb17605079 [0,1,0,0,0,0|3,0,0]=4 623 B14R1.1025 NNC(=O)CCNc1cccc(c1)Cl Amb17605074 [0,1,0,0,0,0|3,0,0]=4 624 B14R1.1025 NNC(=O)CCNc1cccc(c1)F Amb17605076 [0,1,0,0,0,0|3,0,0]=4 625 B14R1.1025 NNC(=O)NCCc1cc(Br)ccc1 Amb25054212 [0,1,0,0,0,0|3,0,0]=4 626 B14R1.1025 OCC(=O)NCCc1cccc(c1)Br Amb17415247 [0,1,0,0,0,0|3,0,0]=4 627 B14R1.1025 OCC(=O)NCCc1cccc(c1)C Amb17401772 [0,1,0,0,0,0|3,0,0]=4 628 B14R1.6449 CC(=C)C(=O)NOCc1ccccc1 Amb24104638 [0,1,0,0,0,0|3,0,0]=4 629 B14R1.6449 CC(=C)C(=O)OCCc1ccccc1 Amb17934134 [0,1,0,0,0,0|2,0,0]=3 630 B14R1.6449 CC(=O)C(=O)CNCc1ccccc1 Amb25103178 [0,1,0,0,0,0|2,0,0]=3 631 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 Amb17401500 [0,1,0,0,0,0|2,0,0]=3 632 B14R1.6449 CC(C(=O)NOCc1ccccc1)C Amb10699573 [0,1,0,0,0,0|3,0,0]=4 633 B14R1.6449 CC(C)=C(C)CNCc1ccccc1 Amb25111160 [0,1,0,0,0,0|3,0,0]=4 634 B14R1.6449 CC(O)C(=O)COCc1ccccc1 Amb25787287 [0,1,0,0,0,0|2,0,0]=3 635 B14R1.6449 CC(O)C(=O)NOCc1ccccc1 Amb25846208 [0,1,0,0,0,0|3,0,0]=4 636 B14R1.6449 CN(C(=O)CCOc1ccccc1)C Amb15739654 [0,1,0,0,0,0|2,0,0]=3 637 B14R1.6449 CN(C)C(=O)C\C=C\c1ccccc1 Amb24110298 [0,1,0,0,0,0|1,0,2]=4 638 B14R1.6449 CN(C)C(=O)NOCc1ccccc1 Amb25166718 [0,1,0,0,0,0|3,0,0]=4 639 B14R1.6449 CN(C)C(=S)CCCc1ccccc1 Amb24072816 [0,1,0,0,0,0|1,1,0]=3 640 B14R1.6449 CN(O)C(=O)CNCc1ccccc1 Amb25672401 [0,1,0,0,0,0|2,0,0]=3 641 B14R1.6449 C[C@@H](N)C(=O)NCCc1ccc[n]c1 Amb18527767 [0,1,0,0,0,0|3,0,0]=4 642 B14R1.6449 C[C@@H](N)C(=O)NCCc1ccccc1 Amb18014657 [0,1,0,0,0,0|2,0,0]=3 643 B14R1.6449 C[C@H](N)C(=O)NOCc1ccccc1 Amb25765468 [0,1,0,0,0,0|3,0,0]=4 644 B14R1.6449 O=C(C(Br)C)NCCc1ccncc1 Amb17322874 [0,1,0,0,0,0|3,0,0]=4 645 B14R1.6449 O=C(C(C)C)NCCc1ccccn1 Amb10698102 [0,1,0,0,0,0|3,0,0]=4 646 B14R1.6449 O=C(C(Cl)C)NCCc1ccccc1 Amb1677739 [0,1,0,0,0,0|2,0,0]=3 647 B14R1.6449 O=C(C(O)C)NCCc1ccccc1 Amb17401758 [0,1,0,0,0,0|2,0,0]=3 648 B14R2.8 CNC1CC(CC1)c2ccccc2 Amb18065568 [0,0,0,1,0,0|2,0,1]=4 649 B14R2.8 CNC=1CC(CN1)c2ccccc2 Amb24375653 [0,0,0,1,0,0|3,0,0]=4 650 B14R2.8 COC1CCC(O1)c2ccccc2 Amb24572881 [0,0,0,1,0,0|0,0,2]=3 651 B14R2.8 Cl\C=C/1\CCC(O1)c2ccccc2 Amb24626654 [0,0,0,1,0,0|2,0,1]=4 652 B14R2.19 BrC1CC(CC1)Cc2ccccc2 Amb25345569 [0,0,0,1,0,0|2,0,1]=4 653 B14R2.19 C=C1CN(Cc2ccccc2)CC1 Amb19334016 [0,0,0,1,0,0|3,0,0]=4 654 B14R2.19 NC1=NC(Cc2ccccc2)CO1 Amb23449444 [0,0,0,1,0,0|2,0,0]=3 655 B14R2.19 NC1=N[C@H](Cc2ccccc2)CS1 Amb25729987 [0,0,0,1,0,0|2,1,0]=4 656 B14R2.19 NC1CC(CC1)Cc2ccccc2 Amb25337996 [0,0,0,1,0,0|2,0,1]=4 657 B14R2.19 O=C1C=C(CO1)Nc2ccccc2 Amb22481357 [0,0,0,1,0,0|1,0,2]=4 658 B14R2.19 O=C1C=C(CO1)Sc2ccccc2 Amb21928058 [0,0,0,1,0,0|1,0,2]=4 659 B14R2.19 O=C1CC(CC1)Sc2cccc[n]2 Amb25731692 [0,0,0,1,0,0|3,0,0]=4 660 B14R2.19 O=C1CC(CC1)Sc2ccccc2 Amb25815229 [0,0,0,1,0,0|2,0,0]=3 661 B14R2.19 O=C1CC(Cc2cc[n]cc2)CN1 Amb24349657 [0,0,0,1,0,0|2,0,0]=3 662 B14R2.19 O=C1CC(Cc2ccc[n]c2)CC1 Amb25684374 [0,0,0,1,0,0|2,0,0]=3 663 B14R2.19 O=C1CC(Cc2ccccc2)=CC1 Amb24422432 [0,0,0,1,0,0|1,0,2]=4 664 B14R2.19 O=C1CC(Cc2ccccc2)CC1 Amb24455173 [0,0,0,1,0,0|1,0,0]=2 665 B14R2.19 O=C1CC(Nc2ccccc2)=NO1 Amb25192239 [0,0,0,1,0,0|2,0,1]=4 666 B14R2.19 O=C1CCC(Cc2cccc[n]2)N1 Amb25763357 [0,0,0,1,0,0|3,0,0]=4 667 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,0|2,0,0]=3 668 B14R2.19 O=C1CCN(C1)Cc2ccccc2 Amb1680105 [0,0,0,1,0,0|2,0,0]=3 669 B14R2.19 O=C1CCN(N1)Cc2ccccc2 Amb2423894 [0,0,0,1,0,0|3,0,0]=4 670 B14R2.19 O=C1CC[C@@H](Cc2ccccc2)N1 Amb25068439 [0,0,0,1,0,0|2,0,0]=3 671 B14R2.19 O=C1CC[C@H](Cc2ccccc2)N1 Amb25365168 [0,0,0,1,0,0|2,0,0]=3 672 B14R2.19 O=C1CN(Cc2ccccc2)CC1 Amb18048933 [0,0,0,1,0,0|2,0,0]=3 673 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CC1 Amb24723978 [0,0,0,1,0,0|1,0,0]=2 674 B14R2.19 O=C1C\C(\CO1)=C\c2ccccc2 Amb24712490 [0,0,0,1,0,0|0,0,2]=3 675 B14R2.19 O=C1NC(Cc2c[n]c[n]c2)CO1 Amb24741029 [0,0,0,1,0,0|3,0,0]=4 676 B14R2.19 O=C1NC(Cc2cc[n]c[n]2)CO1 Amb25082675 [0,0,0,1,0,0|3,0,0]=4 677 B14R2.19 O=C1NC(Cc2ccc[n][n]2)CO1 Amb25192454 [0,0,0,1,0,0|3,0,0]=4 678 B14R2.19 O=C1NC(Cc2cccc[n]2)CO1 Amb25288331 [0,0,0,1,0,0|2,0,0]=3 679 B14R2.19 O=C1NC(Cc2ccccc2)=NO1 Amb18184032 [0,0,0,1,0,0|2,0,1]=4 680 B14R2.19 O=C1NCC(C1)Cc2ccccc2 Amb10608007 [0,0,0,1,0,0|1,0,0]=2 681 B14R2.19 O=C1NCC(C[n+]2ccccc2)O1 Amb25046769 [0,0,0,1,0,0|3,0,0]=4 682 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,0|2,0,0]=3 683 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,0|2,0,0]=3 684 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,0|1,1,0]=3 685 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,0|1,1,0]=3 686 B14R2.19 O=C1OC(Cc2ccccc2)CS1 Amb25726403 [0,0,0,1,0,0|1,1,0]=3 687 B14R2.19 O=C1OCC(O1)Sc2cc[n]cc2 Amb24410445 [0,0,0,1,0,0|3,0,0]=4 688 B14R2.19 O=C1OCC(O1)Sc2cccc[n]2 Amb25749218 [0,0,0,1,0,0|3,0,0]=4 689 B14R2.19 O=C1OCC(O1)Sc2ccccc2 Amb25749160 [0,0,0,1,0,0|2,0,0]=3 690 B14R2.19 O=C1ON=C(C1)Cc2ccccc2 Amb1099037 [0,0,0,1,0,0|1,0,1]=3 691 B14R2.19 OC1CC(Cc2ccccc2)CO1 Amb22752560 [0,0,0,1,0,0|0,0,2]=3 692 B14R2.19 O[C@@H]1C[C@@H](CC1)Cc2ccccc2 Amb25271477 [0,0,0,1,0,0|1,0,2]=4 693 B14R2.19 S=C1NC(Cc2ccccc2)CS1 Amb24079058 [0,0,0,1,0,0|1,2,0]=4 694 B14R2.19 S=C1NCC(Cc2ccccc2)N1 Amb24417734 [0,0,0,1,0,0|2,1,0]=4 695 B14R2.31 NC1CCC1CCc2ccccc2 Amb25757178 [0,0,0,1,0,0|2,0,1]=4 696 B14R2.31 O=C1CCC1CCc2ccccc2 Amb24492658 [0,0,0,1,0,0|1,0,0]=2 697 B14R2.31 O=C1CCC1OCc2ccccc2 Amb22896544 [0,0,0,1,0,0|2,0,0]=3 698 B14R2.31 O=C1CCC1\C=C\c2ccccc2 Amb25309301 [0,0,0,1,0,0|1,0,2]=4 699 B14R2.31 O=C1CC[C@@H]1OCc2ccccc2 Amb24494962 [0,0,0,1,0,0|2,0,0]=3 700 B14R2.31 O=C1CC[C@H]1CCc2ccccc2 Amb24364139 [0,0,0,1,0,0|1,0,0]=2 701 B14R2.31 O=C1COC1CCc2ccccc2 Amb24492472 [0,0,0,1,0,0|2,0,0]=3 702 B14R2.31 O=C1NCC1C#Cc2ccccc2 Amb24548897 [0,0,0,1,0,0|1,0,2]=4 703 B14R2.68 C=C1CNC(CC1)c2ccccc2 Amb25799677 [0,0,0,1,0,0|3,0,0]=4 704 B14R2.68 CC1CCC(CN1)c2ccccc2 Amb18065574 [0,0,0,1,0,0|2,0,1]=4 705 B14R2.68 CC1CNC(CO1)c2ccccc2 Amb18065683 [0,0,0,1,0,0|2,0,1]=4 706 B14R2.68 CN1CCC(CC1)c2ccccc2 Amb10554314 [0,0,0,1,0,0|3,0,0]=4 707 B14R2.68 CN1CCC(CC1)c2ccccc2 Amb24064815 [0,0,0,1,0,0|3,0,0]=4 708 B14R2.68 Cl[C@@H]1CC[C@H](CC1)c2ccccc2 Amb24346981 [0,0,0,1,0,0|2,0,1]=4 709 B14R2.68 FC1CCC(CC1)c2ccccc2 Amb25734477 [0,0,0,1,0,0|2,0,1]=4 710 B14R2.68 NC1=NCC(CS1)c2ccccc2 Amb25060756 [0,0,0,1,0,0|2,1,0]=4 711 B14R2.68 NC1CCC(CC1)c2ccccc2 Amb1120391 [0,0,0,1,0,0|2,0,1]=4 712 B14R2.68 NC=1COC(CN1)c2ccccc2 Amb24407090 [0,0,0,1,0,0|3,0,0]=4 713 B14R2.68 NC=1NCC(CN1)c2ccccc2 Amb18127515 [0,0,0,1,0,0|3,0,0]=4 714 B14R2.68 O=C1CCC(=NN1)c2ccccc2 Amb1017246 [0,0,0,1,0,0|2,0,1]=4 715 B14R2.68 O=C1CCC(CC1)c2c[n]c[n]c2 Amb25306688 [0,0,0,1,0,0|3,0,0]=4 716 B14R2.68 O=C1CCC(CC1)c2cc[n]cc2 Amb18065559 [0,0,0,1,0,0|2,0,0]=3 717 B14R2.68 O=C1CCC(CC1)c2ccc[n]c2 Amb18065558 [0,0,0,1,0,0|2,0,0]=3 718 B14R2.68 O=C1CCC(CC1)c2cccc[n]2 Amb18065557 [0,0,0,1,0,0|2,0,0]=3 719 B14R2.68 O=C1CCC(CC1)c2ccccc2 Amb1208394 [0,0,0,1,0,0|1,0,0]=2 720 B14R2.68 O=C1CCC(CN1)c2cccc[n]2 Amb25110093 [0,0,0,1,0,0|2,0,0]=3 721 B14R2.68 O=C1CCC(CN1)c2ccccc2 Amb17400501 [0,0,0,1,0,0|1,0,0]=2 722 B14R2.68 O=C1CCC(N=N1)c2ccccc2 Amb10576464 [0,0,0,1,0,0|2,0,0]=3 723 B14R2.68 O=C1CCN(C=C1)c2ccccc2 Amb24570373 [0,0,0,1,0,0|2,0,1]=4 724 B14R2.68 O=C1CCN(CC1)c2ccccc2 Amb10070984 [0,0,0,1,0,0|2,0,0]=3 725 B14R2.68 O=C1CCN(OC1)c2ccccc2 Amb25190301 [0,0,0,1,0,0|3,0,0]=4 726 B14R2.68 O=C1CNC(CN1)c2cc[n]cc2 Amb23452783 [0,0,0,1,0,0|3,0,0]=4 727 B14R2.68 O=C1CNC(CN1)c2ccc[n]c2 Amb23452782 [0,0,0,1,0,0|3,0,0]=4 728 B14R2.68 O=C1CNC(CN1)c2ccccc2 Amb23452781 [0,0,0,1,0,0|2,0,0]=3 729 B14R2.68 O=C1CNC(CO1)c2ccccc2 Amb18127910 [0,0,0,1,0,0|1,0,0]=2 730 B14R2.68 O=C1CN[C@@H](CO1)c2ccccc2 Amb22748846 [0,0,0,1,0,0|1,0,0]=2 731 B14R2.68 O=C1CN[C@H](CO1)c2ccccc2 Amb24052958 [0,0,0,1,0,0|1,0,0]=2 732 B14R2.68 O=C1COC(CN1)c2ccccc2 Amb18224547 [0,0,0,1,0,0|2,0,0]=3 733 B14R2.68 O=C1CSC(SC1)c2ccccc2 Amb22461597 [0,0,0,1,0,0|3,0,0]=4 734 B14R2.68 O=C1NCC(CN1)c2ccc[n]c2 Amb25776935 [0,0,0,1,0,0|3,0,0]=4 735 B14R2.68 O=C1NCC(CN1)c2ccccc2 Amb25295398 [0,0,0,1,0,0|2,0,0]=3 736 B14R2.68 O=C1NN=C(CO1)c2ccccc2 Amb24715861 [0,0,0,1,0,0|2,0,1]=4 737 B14R2.68 OC1CCC(CC1)c2ccccc2 Amb1786614 [0,0,0,1,0,0|1,0,2]=4 738 B14R2.68 S=C1NCC(CN1)c2ccccc2 Amb24090250 [0,0,0,1,0,0|2,1,0]=4 739 B14R2.95 BrCC(=O)N1CCc2c1cccc2 Amb2089065 [0,0,0,1,0,0|3,0,0]=4 740 B14R2.95 C#CC(=O)C1CNc2ccccc21 Amb24745431 [0,0,0,1,0,0|2,0,1]=4 741 B14R2.95 C#CC(=O)C1COc2ccccc21 Amb25850288 [0,0,0,1,0,0|2,0,1]=4 742 B14R2.95 C#CC(=O)C1CSc2ccccc21 Amb25304792 [0,0,0,1,0,0|2,0,1]=4 743 B14R2.95 C=CC(=O)C1CCc2ccccc21 Amb25133333 [0,0,0,1,0,0|1,0,1]=3 744 B14R2.95 C=CC(=O)C1CNc2ccccc21 Amb25837019 [0,0,0,1,0,0|2,0,1]=4 745 B14R2.95 CCC(=O)C1CCc2ccc[n]c21 Amb25741822 [0,0,0,1,0,0|2,0,0]=3 746 B14R2.95 CCC(=O)C1CCc2ccccc21 Amb24593074 [0,0,0,1,0,0|1,0,0]=2 747 B14R2.95 CCC(=O)C1CNc2ccccc21 Amb25228919 [0,0,0,1,0,0|2,0,0]=3 748 B14R2.95 CCC(=O)N1CCc2c1cccc2 Amb1672516 [0,0,0,1,0,0|2,0,0]=3 749 B14R2.95 CCC(Br)C1CCc2ccccc21 Amb24489656 [0,0,0,1,0,0|2,0,1]=4 750 B14R2.95 CCN(C)C1CCc2ccccc21 Amb20637248 [0,0,0,1,0,0|3,0,0]=4 751 B14R2.95 CCS(=O)N1CCc2ccccc12 Amb25348331 [0,0,0,1,0,0|3,0,0]=4 752 B14R2.95 CC[C@H](N)C1CCc2ccccc21 Amb24427847 [0,0,0,1,0,0|2,0,1]=4 753 B14R2.95 CNC(=N)N1CCc2ccccc12 Amb18183947 [0,0,0,1,0,0|3,0,0]=4 754 B14R2.95 CNC(=O)C1CCc2ccccc21 Amb24658312 [0,0,0,1,0,0|1,0,0]=2 755 B14R2.95 CNC(=O)C1CSc2ccccc21 Amb25832994 [0,0,0,1,0,0|2,0,0]=3 756 B14R2.95 CNC(=O)N1CCc2ccccc12 Amb24490123 [0,0,0,1,0,0|2,0,0]=3 757 B14R2.95 COC(=N)C1CCc2ccccc21 Amb25345442 [0,0,0,1,0,0|1,0,0]=2 758 B14R2.95 COC(=N)C1COc2ccccc21 Amb24492353 [0,0,0,1,0,0|2,0,0]=3 759 B14R2.95 COC(=O)C1CCc2[n]c[n]cc21 Amb23596897 [0,0,0,1,0,0|2,0,0]=3 760 B14R2.95 COC(=O)C1CCc2[n]cccc21 Amb25262859 [0,0,0,1,0,0|1,0,0]=2 761 B14R2.95 COC(=O)C1CCc2c1cccc2 Amb10563171 [0,0,0,1,0,0|0,0,0]=1 762 B14R2.95 COC(=O)C1CNc2ccccc21 Amb19320764 [0,0,0,1,0,0|1,0,0]=2 763 B14R2.95 COC(=O)C1CNc2ccccc21 Amb22234034 [0,0,0,1,0,0|1,0,0]=2 764 B14R2.95 COC(=O)C1COc2ccccc21 Amb22059417 [0,0,0,1,0,0|1,0,0]=2 765 B14R2.95 COC(=O)C1CSc2ccccc21 Amb24489808 [0,0,0,1,0,0|1,0,0]=2 766 B14R2.95 COC(=O)C1NCc2c1cccc2 Amb10066941 [0,0,0,1,0,0|1,0,0]=2 767 B14R2.95 COC(=O)C1NCc2ccccc21 Amb22490554 [0,0,0,1,0,0|1,0,0]=2 768 B14R2.95 COC(=O)N1CCc2cc[n]cc12 Amb25318238 [0,0,0,1,0,0|2,0,0]=3 769 B14R2.95 COC(=O)[C@H]1NCc2ccccc21 Amb25780034 [0,0,0,1,0,0|1,0,0]=2 770 B14R2.95 COC(=O)[n]1[n]cc2ccccc12 Amb25709542 [0,0,0,1,0,0|2,0,1]=4 771 B14R2.95 COC(=O)[n]1c[n]c2ccccc12 Amb24078482 [0,0,0,1,0,0|2,0,1]=4 772 B14R2.95 COC(=O)[n]1ccc2ccccc12 Amb24106374 [0,0,0,1,0,0|1,0,2]=4 773 B14R2.95 COC(=O)c1[nH]cc2ccccc21 Amb22499248 [0,0,0,1,0,0|1,0,2]=4 774 B14R2.95 COC(=O)c1[n]oc2ccccc12 Amb23437527 [0,0,0,1,0,0|2,0,1]=4 775 B14R2.95 COC(=O)c1[s]cc2ccccc21 Amb24066382 [0,0,0,1,0,0|1,0,2]=4 776 B14R2.95 COC(=O)c1c[s]c2ccccc12 Amb18330285 [0,0,0,1,0,0|1,0,2]=4 777 B14R2.95 COC(=O)c1coc2ccccc12 Amb22269388 [0,0,0,1,0,0|1,0,2]=4 778 B14R2.95 COC(=O)c1n[nH]c2c1cccc2 Amb2223290 [0,0,0,1,0,0|2,0,1]=4 779 B14R2.95 COC(=O)c1onc2c1cccc2 Amb10553624 [0,0,0,1,0,0|2,0,1]=4 780 B14R2.95 COC(=O)n1nnc2c1cccc2 Amb10559902 [0,0,0,1,0,0|3,0,0]=4 781 B14R2.95 N#CC(=O)N1CCc2ccccc12 Amb25309711 [0,0,0,1,0,0|3,0,0]=4 782 B14R2.95 NCC(=O)N1CCc2c1cccc2 Amb13952606 [0,0,0,1,0,0|3,0,0]=4 783 B14R2.95 NNC(=O)C1CCc2ccccc21 Amb25689061 [0,0,0,1,0,0|2,0,0]=3 784 B14R2.95 NNC(=O)C1CNc2ccccc21 Amb24582630 [0,0,0,1,0,0|3,0,0]=4 785 B14R2.95 N\C(=N\N)\C1CCc2ccccc21 Amb25799992 [0,0,0,1,0,0|3,0,0]=4 786 B14R2.95 N\C(=N\O)\C1CCc2ccccc21 Amb24366744 [0,0,0,1,0,0|3,0,0]=4 787 B14R2.95 O=C(C=O)N1CCc2ccccc12 Amb25723267 [0,0,0,1,0,0|3,0,0]=4 788 B14R2.95 O=C(CBr)C1COc2ccccc21 Amb24452410 [0,0,0,1,0,0|3,0,0]=4 789 B14R2.95 O=C(CBr)C1CSc2ccccc21 Amb25670351 [0,0,0,1,0,0|3,0,0]=4 790 B14R2.95 O=C(CBr)C1NCc2ccccc21 Amb25300659 [0,0,0,1,0,0|3,0,0]=4 791 B14R2.95 O=C(CCl)C1CSc2ccccc21 Amb25678752 [0,0,0,1,0,0|3,0,0]=4 792 B14R2.95 O=C(CS)N1CCc2ccccc12 Amb20413873 [0,0,0,1,0,0|3,0,0]=4 793 B14R2.95 ONC(=O)C1CCc2ccccc21 Amb25663645 [0,0,0,1,0,0|2,0,0]=3 794 B14R2.95 ONC(=O)C1COc2ccccc21 Amb25128026 [0,0,0,1,0,0|3,0,0]=4 795 B14R2.95 ONC(=O)C1CSc2ccccc21 Amb24489803 [0,0,0,1,0,0|3,0,0]=4 796 B14R2.143 CCN1Cc2ccccc2CCC1 Amb25284030 [0,0,0,1,0,0|3,0,0]=4 797 B14R2.143 CNC=1CCCc2ccccc2C1 Amb24461692 [0,0,0,1,0,0|2,0,0]=3 798 B14R2.143 CSC1CCCc2ccccc2N1 Amb25752046 [0,0,0,1,0,0|1,1,1]=4 799 B14R2.143 CSC=1CCCc2ccccc2N1 Amb24704313 [0,0,0,1,0,0|1,1,0]=3 800 B14R2.143 O=CC=1CCCc2ccccc2C1 Amb25770552 [0,0,0,1,0,0|3,0,0]=4 801 B14R2.279 C=C1C(=O)CCCc2ccccc21 Amb25273029 [0,0,0,1,0,0|1,0,1]=3 802 B14R2.279 CC1C(=O)CC=Cc2ccccc21 Amb25838678 [0,0,0,1,0,0|1,0,2]=4 803 B14R2.279 CC1C(=O)CCCc2ccccc21 Amb24491400 [0,0,0,1,0,0|1,0,0]=2 804 B14R2.279 CC1C(=O)NCCc2ccccc21 Amb25124711 [0,0,0,1,0,0|2,0,0]=3 805 B14R2.279 CN1C(=O)CCNc2ccccc12 Amb18224515 [0,0,0,1,0,0|2,0,0]=3 806 B14R2.279 CN1C(=O)OCCc2ccccc12 Amb24526707 [0,0,0,1,0,0|2,0,0]=3 807 B14R2.279 NC1C(=O)NCCc2ccccc21 Amb22491660 [0,0,0,1,0,0|3,0,0]=4 808 B14R2.279 NN1c2ccccc2CCCC1=O Amb17772370 [0,0,0,1,0,0|2,0,0]=3 809 B14R2.279 O=C1CCCc2ccccc2N1Cl Amb24555131 [0,0,0,1,0,0|2,0,0]=3 810 B14R2.279 O=C1CCOc2c(N1C)cccc2 Amb17570222 [0,0,0,1,0,0|2,0,0]=3 811 B14R2.279 O=C1CCOc2ccccc2C1=O Amb24495335 [0,0,0,1,0,0|3,0,0]=4 812 B14R2.279 O=C1NCCc2c(C1N)cccc2 Amb10067379 [0,0,0,1,0,0|3,0,0]=4 813 B14R2.279 OC1C(=O)SCCc2ccccc21 Amb25306580 [0,0,0,1,0,0|3,0,0]=4 814 B14R2.280 O=C1CC=Cc2ccccc2CC1 Amb25834467 [0,0,0,1,0,0|1,0,2]=4 815 B14R2.280 O=C1CCCc2ccccc2C=C1 Amb24408507 [0,0,0,1,0,0|1,0,1]=3 816 B14R2.280 O=C1CCNc2[n]cccc2CN1 Amb25738473 [0,0,0,1,0,0|3,0,0]=4 817 B14R2.280 O=C1CCNc2ccccc2CN1 Amb23403550 [0,0,0,1,0,0|2,0,0]=3 818 B14R2.280 O=C1COc2ccccc2CCN1 Amb24398696 [0,0,0,1,0,0|3,0,0]=4 819 B14R2.280 OC1CCCc2ccccc2CC1 Amb25381459 [0,0,0,1,0,0|1,0,2]=4 820 B14R2.427 C=C1C(Cc2ccccc2)CC1=O Amb25263562 [0,0,0,1,0,0|1,0,1]=3 821 B14R2.427 CC1C(Cc2ccccc2)NC1=O Amb24647838 [0,0,0,1,0,0|2,0,0]=3 822 B14R2.427 C[C@@H]1[C@H](NC1=O)Sc2ccccc2 Amb24512994 [0,0,0,1,0,0|3,0,0]=4 823 B14R2.427 C[C@H]1[C@H](NC1=O)Sc2ccccc2 Amb25317654 [0,0,0,1,0,0|3,0,0]=4 824 B14R2.427 NC1C(Cc2ccccc2)NC1=O Amb18196732 [0,0,0,1,0,0|3,0,0]=4 825 B14R2.427 O=C1CN(Cc2ccccc2)C1=O Amb25770465 [0,0,0,1,0,0|3,0,0]=4 826 B14R2.427 OC1C(Cc2ccccc2)NC1=O Amb24453779 [0,0,0,1,0,0|3,0,0]=4 827 B14R2.958 C=CC(=O)C1OC1c2ccccc2 Amb25807537 [0,0,0,1,0,0|2,0,1]=4 828 B14R2.958 C=CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24633398 [0,0,0,1,0,0|1,0,1]=3 829 B14R2.958 CC(NC)C1CC1c2ccccc2 Amb25841242 [0,0,0,1,0,0|2,0,1]=4 830 B14R2.958 CC(NC)[C@@H]1C[C@H]1c2ccccc2 Amb25371287 [0,0,0,1,0,0|2,0,1]=4 831 B14R2.958 CCC(=O)C1CC1c2ccccc2 Amb24534293 [0,0,0,1,0,0|1,0,0]=2 832 B14R2.958 CCC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25322800 [0,0,0,1,0,0|1,0,0]=2 833 B14R2.958 CCC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24612438 [0,0,0,1,0,0|2,0,0]=3 834 B14R2.958 CCC(Cl)C1CC1c2ccccc2 Amb25051781 [0,0,0,1,0,0|2,0,1]=4 835 B14R2.958 CCC(N)C1CC1c2ccccc2 Amb24471079 [0,0,0,1,0,0|2,0,1]=4 836 B14R2.958 CCC(O)C1CC1c2ccccc2 Amb25090667 [0,0,0,1,0,0|1,0,2]=4 837 B14R2.958 CCC(O)[C@H]1C[C@@H]1c2ccccc2 Amb24573453 [0,0,0,1,0,0|1,0,2]=4 838 B14R2.958 CC[C@@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520373 [0,0,0,1,0,0|1,0,2]=4 839 B14R2.958 CC[C@@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb25345047 [0,0,0,1,0,0|1,0,2]=4 840 B14R2.958 CC[C@H](O)[C@@H]1C[C@H]1c2ccccc2 Amb24520210 [0,0,0,1,0,0|1,0,2]=4 841 B14R2.958 CC[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24661094 [0,0,0,1,0,0|1,0,2]=4 842 B14R2.958 CNC(=O)C1CC1c2cc[n]cc2 Amb25132180 [0,0,0,1,0,0|2,0,0]=3 843 B14R2.958 CNC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24617709 [0,0,0,1,0,0|2,0,0]=3 844 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccc[n]c2 Amb25355670 [0,0,0,1,0,0|2,0,0]=3 845 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25226125 [0,0,0,1,0,0|1,0,0]=2 846 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,0,0,1,0,0|2,0,0]=3 847 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24610051 [0,0,0,1,0,0|2,0,0]=3 848 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24605065 [0,0,0,1,0,0|1,0,0]=2 849 B14R2.958 CNC(=S)C1CC1c2ccccc2 Amb24428152 [0,0,0,1,0,0|1,1,0]=3 850 B14R2.958 CNC(=S)[C@H]1C[C@@H]1c2ccccc2 Amb25324077 [0,0,0,1,0,0|1,1,0]=3 851 B14R2.958 COC(=O)C1CC1c2cc[n]cc2 Amb25355787 [0,0,0,1,0,0|1,0,0]=2 852 B14R2.958 COC(=O)C1CC1c2ccc[n]c2 Amb25852071 [0,0,0,1,0,0|1,0,0]=2 853 B14R2.958 COC(=O)C1N=C1c2ccccc2 Amb22325239 [0,0,0,1,0,0|1,0,1]=3 854 B14R2.958 COC(=O)N1CC1c2ccccc2 Amb1039317 [0,0,0,1,0,0|1,0,0]=2 855 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2cccc[n]2 Amb24617301 [0,0,0,1,0,0|1,0,0]=2 856 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,0,0,1,0,0|0,0,0]=1 857 B14R2.958 C\C(=N\N)\[C@@H]1C[C@H]1c2ccccc2 Amb25031668 [0,0,0,1,0,0|3,0,0]=4 858 B14R2.958 N=C(NO)C1CC1c2ccccc2 Amb25312724 [0,0,0,1,0,0|3,0,0]=4 859 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,0,0,1,0,0|2,0,0]=3 860 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,0,0,1,0,0|2,0,0]=3 861 B14R2.958 NNC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24501421 [0,0,0,1,0,0|2,0,0]=3 862 B14R2.958 O=C(CBr)C1CC1c2ccccc2 Amb25220775 [0,0,0,1,0,0|2,0,0]=3 863 B14R2.958 ONC(=O)C1CC1c2ccc[n]c2 Amb25331855 [0,0,0,1,0,0|3,0,0]=4 864 B14R2.958 ONC(=O)C1CC1c2ccccc2 Amb25332697 [0,0,0,1,0,0|2,0,0]=3 865 B14R2.958 ONC(=O)[C@@H]1C[C@H]1c2ccc[n]c2 Amb24434028 [0,0,0,1,0,0|3,0,0]=4 866 B14R2.3019 C(OCc1ccccc1)C2CCO2 Amb25057666 [0,0,0,1,0,0|2,0,1]=4 867 B14R2.3019 C(OCc1ccccc1)[C@@H]2CCO2 Amb22746826 [0,0,0,1,0,0|2,0,1]=4 868 B14R2.3459 CNC1(C)CCCc2ccccc12 Amb24748095 [0,0,0,1,0,0|2,0,1]=4 869 B14R2.4514 C=C1C(COC1=O)c2ccccc2 Amb24417074 [0,0,0,1,0,0|2,0,1]=4 870 B14R2.4514 CC1C(C=CC1=O)c2ccccc2 Amb25859267 [0,0,0,1,0,0|1,0,2]=4 871 B14R2.4514 CC1C(CCC1=O)c2c[n]c[n]c2 Amb25833854 [0,0,0,1,0,0|3,0,0]=4 872 B14R2.4514 CC1C(CCC1=O)c2c[n]cc[n]2 Amb25143968 [0,0,0,1,0,0|3,0,0]=4 873 B14R2.4514 CC1C(CCC1=O)c2ccccc2 Amb24051457 [0,0,0,1,0,0|1,0,0]=2 874 B14R2.4514 CC1C(CCN1C)c2ccccc2 Amb25852726 [0,0,0,1,0,0|3,0,0]=4 875 B14R2.4514 CC1C(CNC1=O)c2c[n]ccc2 Amb24764179 [0,0,0,1,0,0|3,0,0]=4 876 B14R2.4514 CC1C(CNC1=O)c2cccc[n]2 Amb24560750 [0,0,0,1,0,0|3,0,0]=4 877 B14R2.4514 CC1C(CNC1=O)c2ccccc2 Amb24312552 [0,0,0,1,0,0|2,0,0]=3 878 B14R2.4514 CC1C(Cl)CCC1c2ccccc2 Amb25099721 [0,0,0,1,0,0|2,0,1]=4 879 B14R2.4514 CC1C(N)CCC1c2ccccc2 Amb25667957 [0,0,0,1,0,0|2,0,1]=4 880 B14R2.4514 CC1C(OCC1=O)c2ccccc2 Amb25370856 [0,0,0,1,0,0|2,0,0]=3 881 B14R2.4514 CC=1C(=O)CCC1c2cccc[n]2 Amb25353383 [0,0,0,1,0,0|2,0,1]=4 882 B14R2.4514 CC=1C(=O)CCC1c2ccccc2 Amb24408335 [0,0,0,1,0,0|1,0,1]=3 883 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb22054764 [0,0,0,1,0,0|2,0,0]=3 884 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb24064826 [0,0,0,1,0,0|2,0,0]=3 885 B14R2.4514 CN1C(CNC1=O)c2cc[n]cc2 Amb24672456 [0,0,0,1,0,0|3,0,0]=4 886 B14R2.4514 CN1C(CNC1=O)c2ccc[n]c2 Amb25689003 [0,0,0,1,0,0|3,0,0]=4 887 B14R2.4514 CN1C(CNC1=O)c2cccc[n]2 Amb24718293 [0,0,0,1,0,0|3,0,0]=4 888 B14R2.4514 CN1C(CNC1=O)c2ccccc2 Amb25218843 [0,0,0,1,0,0|2,0,0]=3 889 B14R2.4514 CN1C(CNC1=S)c2ccccc2 Amb24064843 [0,0,0,1,0,0|2,1,0]=4 890 B14R2.4514 CN1C(COC1=O)c2ccccc2 Amb25191541 [0,0,0,1,0,0|2,0,0]=3 891 B14R2.4514 CN1C(NCC1=O)c2ccc[n]c2 Amb25706599 [0,0,0,1,0,0|3,0,0]=4 892 B14R2.4514 CN1C(NCC1=O)c2cccc[n]2 Amb24509997 [0,0,0,1,0,0|3,0,0]=4 893 B14R2.4514 CN1C(SCC1=S)c2ccccc2 Amb24099817 [0,0,0,1,0,0|2,1,0]=4 894 B14R2.4514 CN1[C@@H](NCC1=O)c2ccccc2 Amb25232599 [0,0,0,1,0,0|2,0,0]=3 895 B14R2.4514 CN1[C@H](COC1=O)c2ccccc2 Amb24362005 [0,0,0,1,0,0|2,0,0]=3 896 B14R2.4514 C[C@H]1[C@@H](CCC1=O)c2ccccc2 Amb25327910 [0,0,0,1,0,0|1,0,0]=2 897 B14R2.4514 C[C@H]1[C@@H](OCC1=O)c2ccccc2 Amb24512682 [0,0,0,1,0,0|2,0,0]=3 898 B14R2.4514 O=C1CCC(C1Cl)c2ccccc2 Amb25300341 [0,0,0,1,0,0|2,0,0]=3 899 B14R2.4514 O=C1CCC(N1C)c2ccccn2 Amb10069450 [0,0,0,1,0,0|2,0,0]=3 900 B14R2.4514 O=C1CCC(N1C)c2cccnc2 Amb10845303 [0,0,0,1,0,0|2,0,0]=3 901 B14R2.4514 O=C1CCN(c2ccccc2)C1=O Amb18795566 [0,0,0,1,0,0|3,0,0]=4 902 B14R2.4514 O=C1CC[C@@H](N1C)c2cccnc2 Amb10071651 [0,0,0,1,0,0|2,0,0]=3 903 B14R2.4514 OC1C(CNC1=O)c2ccccc2 Amb24490122 [0,0,0,1,0,0|3,0,0]=4 904 B14R2.4514 OC=1C(=O)CCC1c2ccccc2 Amb25754959 [0,0,0,1,0,0|2,0,1]=4 905 B14R2.4881 CC1(COCc2ccccc2)CO1 Amb22347502 [0,0,0,1,0,0|2,0,1]=4 906 B14R2.4881 NC1(CCCc2ccccc2)CC1 Amb18560538 [0,0,0,1,0,0|2,0,1]=4 907 B14R2.35816 C=CC(=O)CC1Cc2ccccc21 Amb24685567 [0,0,0,1,0,0|1,0,1]=3 908 B14R2.35816 CCC(=O)NC1Cc2ccccc21 Amb24404446 [0,0,0,1,0,0|2,0,0]=3 909 B14R2.35816 CCC(Cl)CC1Cc2ccccc21 Amb24750024 [0,0,0,1,0,0|2,0,1]=4 910 B14R2.35816 CCC(N)CC1Cc2ccccc21 Amb25765106 [0,0,0,1,0,0|2,0,1]=4 911 B14R2.35816 CCC(O)CC1Cc2ccccc21 Amb25683595 [0,0,0,1,0,0|1,0,2]=4 912 B14R2.35816 CNC(=S)NC1Cc2ccccc21 Amb24529944 [0,0,0,1,0,0|2,1,0]=4 913 B14R2.35816 COC(=O)NC1Cc2ccccc21 Amb25725896 [0,0,0,1,0,0|1,0,0]=2 914 B14R2.35816 OCC(=O)NC1Cc2ccccc21 Amb25749238 [0,0,0,1,0,0|3,0,0]=4 915 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [0,0,0,0,1,0|3,0,0]=4 916 B12R1.27 C#CC(=O)CCc1cc[n]cc1 Amb24684499 [0,0,0,0,1,0|2,0,1]=4 917 B12R1.27 C#CC(=O)CCc1ccc[n]c1 Amb25271085 [0,0,0,0,1,0|2,0,1]=4 918 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [0,0,0,0,1,0|1,0,1]=3 919 B12R1.27 C#CC(=O)CNc1ccccc1 Amb24359731 [0,0,0,0,1,0|2,0,1]=4 920 B12R1.27 C#CC(=O)COc1ccccc1 Amb24483847 [0,0,0,0,1,0|2,0,1]=4 921 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [0,0,0,0,1,0|2,0,1]=4 922 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [0,0,0,0,1,0|2,0,1]=4 923 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [0,0,0,0,1,0|1,0,1]=3 924 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [0,0,0,0,1,0|2,0,1]=4 925 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [0,0,0,0,1,0|2,0,1]=4 926 B12R1.27 CCC(=C)CNc1ccccc1 Amb25093473 [0,0,0,0,1,0|3,0,0]=4 927 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [0,0,0,0,1,0|3,0,0]=4 928 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [0,0,0,0,1,0|1,0,2]=4 929 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [0,0,0,0,1,0|3,0,0]=4 930 B12R1.27 CCC(=O)NCc1ccncc1 Amb17798077 [0,0,0,0,1,0|3,0,0]=4 931 B12R1.27 CCC(=O)O[Hg]c1ccccc1 Amb22359615 [0,0,0,0,1,0|3,0,0]=4 932 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [0,0,0,0,1,0|1,0,2]=4 933 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [0,0,0,0,1,0|1,0,2]=4 934 B12R1.27 CCC(=O)\N=N\c1ccccc1 Amb24644165 [0,0,0,0,1,0|3,0,0]=4 935 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [0,0,0,0,1,0|1,0,2]=4 936 B12R1.27 CCS(=O)NCc1ccccc1 Amb25359778 [0,0,0,0,1,0|3,0,0]=4 937 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [0,0,0,0,1,0|3,0,0]=4 938 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [0,0,0,0,1,0|3,0,0]=4 939 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [0,0,0,0,1,0|3,0,0]=4 940 B12R1.27 CNC(=O)C#Cc1ccccc1 Amb2106613 [0,0,0,0,1,0|1,0,2]=4 941 B12R1.27 CNC(=O)CCc1c[n]c[n]c1 Amb24388414 [0,0,0,0,1,0|3,0,0]=4 942 B12R1.27 CNC(=O)COc1ccc[n]c1 Amb24622499 [0,0,0,0,1,0|3,0,0]=4 943 B12R1.27 CNC(=O)CSc1ccccn1 Amb13953848 [0,0,0,0,1,0|3,0,0]=4 944 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [0,0,0,0,1,0|2,0,0]=3 945 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [0,0,0,0,1,0|3,0,0]=4 946 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [0,0,0,0,1,0|3,0,0]=4 947 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [0,0,0,0,1,0|3,0,0]=4 948 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [0,0,0,0,1,0|3,0,0]=4 949 B12R1.27 CNC(=O)OCc1ccc[n]c1 Amb24532586 [0,0,0,0,1,0|3,0,0]=4 950 B12R1.27 CNC(=O)SCc1cccc[n]1 Amb25054647 [0,0,0,0,1,0|3,0,0]=4 951 B12R1.27 CNC(=O)\N=C\c1ccccc1 Amb24497304 [0,0,0,0,1,0|2,0,1]=4 952 B12R1.27 CNC(=O)\N=N\c1ccccc1 Amb25313077 [0,0,0,0,1,0|3,0,0]=4 953 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [0,0,0,0,1,0|2,0,1]=4 954 B12R1.27 COC(=N)CCc1cc[n]cc1 Amb18563635 [0,0,0,0,1,0|2,0,0]=3 955 B12R1.27 COC(=N)CCc1ccc[n]c1 Amb18563630 [0,0,0,0,1,0|2,0,0]=3 956 B12R1.27 COC(=N)CCc1cccc[n]1 Amb18563625 [0,0,0,0,1,0|2,0,0]=3 957 B12R1.27 COC(=N)CNc1ccccc1 Amb24597022 [0,0,0,0,1,0|2,0,0]=3 958 B12R1.27 COC(=N)COc1ccccc1 Amb18798404 [0,0,0,0,1,0|2,0,0]=3 959 B12R1.27 COC(=O)/C=C/c1cccnc1 Amb17844385 [0,0,0,0,1,0|1,0,2]=4 960 B12R1.27 COC(=O)C#Cc1ccccn1 Amb1039304 [0,0,0,0,1,0|1,0,2]=4 961 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb20668041 [0,0,0,0,1,0|1,0,2]=4 962 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb24074160 [0,0,0,0,1,0|1,0,2]=4 963 B12R1.27 COC(=O)CCc1c[n]c[n]c1 Amb21922892 [0,0,0,0,1,0|2,0,0]=3 964 B12R1.27 COC(=O)CCc1cc[n][n]c1 Amb23454523 [0,0,0,0,1,0|2,0,0]=3 965 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [0,0,0,0,1,0|1,0,0]=2 966 B12R1.27 COC(=O)CNc1c[n]c[n]c1 Amb18270088 [0,0,0,0,1,0|3,0,0]=4 967 B12R1.27 COC(=O)CNc1cc[n]c[n]1 Amb18788537 [0,0,0,0,1,0|3,0,0]=4 968 B12R1.27 COC(=O)CNc1ccc[n][n]1 Amb19023174 [0,0,0,0,1,0|3,0,0]=4 969 B12R1.27 COC(=O)CNc1ccc[n]c1 Amb18270093 [0,0,0,0,1,0|2,0,0]=3 970 B12R1.27 COC(=O)COc1cccc[n]1 Amb24095859 [0,0,0,0,1,0|2,0,0]=3 971 B12R1.27 COC(=O)CSc1cccc[n]1 Amb22280333 [0,0,0,0,1,0|2,0,0]=3 972 B12R1.27 COC(=O)NCc1cc[n]c[n]1 Amb25321776 [0,0,0,0,1,0|3,0,0]=4 973 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [0,0,0,0,1,0|2,0,0]=3 974 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [0,0,0,0,1,0|2,0,0]=3 975 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [0,0,0,0,1,0|1,0,0]=2 976 B12R1.27 COC(=O)\C=C\c1cccc[n]1 Amb25036096 [0,0,0,0,1,0|1,0,2]=4 977 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb10604946 [0,0,0,0,1,0|1,0,2]=4 978 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [0,0,0,0,1,0|2,0,0]=3 979 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [0,0,0,0,1,0|2,0,1]=4 980 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [0,0,0,0,1,0|2,1,0]=4 981 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [0,0,0,0,1,0|1,1,0]=3 982 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [0,0,0,0,1,0|3,0,0]=4 983 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [0,0,0,0,1,0|3,0,0]=4 984 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [0,0,0,0,1,0|3,0,0]=4 985 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [0,0,0,0,1,0|2,0,0]=3 986 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [0,0,0,0,1,0|3,0,0]=4 987 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [0,0,0,0,1,0|2,0,0]=3 988 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [0,0,0,0,1,0|2,0,0]=3 989 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [0,0,0,0,1,0|3,0,0]=4 990 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [0,0,0,0,1,0|3,0,0]=4 991 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [0,0,0,0,1,0|3,0,0]=4 992 B12R1.27 NNC(=O)CCc1cccc[n]1 Amb25299317 [0,0,0,0,1,0|3,0,0]=4 993 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [0,0,0,0,1,0|2,0,0]=3 994 B12R1.27 NNC(=O)CCc1ccncc1 Amb10553044 [0,0,0,0,1,0|3,0,0]=4 995 B12R1.27 NNC(=O)CNc1ccccc1 Amb1104534 [0,0,0,0,1,0|3,0,0]=4 996 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [0,0,0,0,1,0|3,0,0]=4 997 B12R1.27 N\C(\CCc1ccccc1)=N\N Amb18788201 [0,0,0,0,1,0|3,0,0]=4 998 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [0,0,0,0,1,0|3,0,0]=4 999 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [0,0,0,0,1,0|3,0,0]=4 1000 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [0,0,0,0,1,0|2,0,0]=3 1001 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [0,0,0,0,1,0|3,0,0]=4 1002 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [0,0,0,0,1,0|3,0,0]=4 1003 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [0,0,0,0,1,0|3,0,0]=4 1004 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [0,0,0,0,1,0|3,0,0]=4 1005 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [0,0,0,0,1,0|3,0,0]=4 1006 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [0,0,0,0,1,0|3,0,0]=4 1007 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [0,0,0,0,1,0|3,0,0]=4 1008 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [0,0,0,0,1,0|3,0,0]=4 1009 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [0,0,0,0,1,0|2,0,0]=3 1010 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [0,0,0,0,1,0|3,0,0]=4 1011 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [0,0,0,0,1,0|3,0,0]=4 1012 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [0,0,0,0,1,0|3,0,0]=4 1013 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [0,0,0,0,1,0|3,0,0]=4 1014 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [0,0,0,0,1,0|3,0,0]=4 1015 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [0,0,0,0,1,0|3,0,0]=4 1016 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [0,0,0,0,1,0|3,0,0]=4 1017 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [0,0,0,0,1,0|3,0,0]=4 1018 B12R1.477 CCC(=O)NCCc1cscc1 Amb13821362 [0,0,0,0,1,0|3,0,0]=4 1019 B12R1.477 CNC(=O)NCC[n]1cccc1 Amb25060446 [0,0,0,0,1,0|3,0,0]=4 1020 B12R1.477 CNC(=O)NCCc1ccc[s]1 Amb24351945 [0,0,0,0,1,0|3,0,0]=4 1021 B12R1.477 COC(=O)C#CCc1ccc[s]1 Amb25736223 [0,0,0,0,1,0|1,0,2]=4 1022 B12R1.477 COC(=O)CCC[n]1cc[n][n]1 Amb23449454 [0,0,0,0,1,0|3,0,0]=4 1023 B12R1.477 COC(=O)CCC[n]1cccc1 Amb22971177 [0,0,0,0,1,0|1,0,0]=2 1024 B12R1.477 COC(=O)CCCc1cc[s]c1 Amb22494756 [0,0,0,0,1,0|1,0,0]=2 1025 B12R1.477 COC(=O)NCCc1cscc1 Amb13821363 [0,0,0,0,1,0|2,0,0]=3 1026 B14R1.716 BrCC(=O)NCCCc1ccccc1 Amb17323643 [0,0,0,0,0,1|2,0,0]=3 1027 B14R1.716 BrCC(=O)NCCOc1ccccc1 Amb17333035 [0,0,0,0,0,1|3,0,0]=4 1028 B14R1.716 C#CC(=O)NCCNc1ccccc1 Amb24723511 [0,0,0,0,0,1|2,0,1]=4 1029 B14R1.716 C=C(CCOCc1ccccc1)C=O Amb24419955 [0,0,0,0,0,1|3,0,0]=4 1030 B14R1.716 C=C(CCl)CCOCc1ccccc1 Amb24653568 [0,0,0,0,0,1|3,0,0]=4 1031 B14R1.716 C=CC(=O)OCCCc1ccccc1 Amb17934135 [0,0,0,0,0,1|1,0,1]=3 1032 B14R1.716 C=CC(=O)OCCSc1ccccc1 Amb17934210 [0,0,0,0,0,1|2,0,1]=4 1033 B14R1.716 CCC(=O)CCC#Cc1ccccc1 Amb19070057 [0,0,0,0,0,1|1,0,1]=3 1034 B14R1.716 CCC(=O)CCCCc1ccccc1 Amb17234942 [0,0,0,0,0,1|1,0,0]=2 1035 B14R1.716 CCC(=O)CCCCc1cccnc1 Amb17235102 [0,0,0,0,0,1|2,0,0]=3 1036 B14R1.716 CCC(=O)CCNCc1ccccc1 Amb25040589 [0,0,0,0,0,1|1,0,0]=2 1037 B14R1.716 CCC(=O)NCC#Cc1ccccc1 Amb10562814 [0,0,0,0,0,1|1,0,2]=4 1038 B14R1.716 CCC(=O)NCCSc1ccccc1 Amb19558300 [0,0,0,0,0,1|2,0,0]=3 1039 B14R1.716 CCC(=O)OCC#Cc1ccccc1 Amb25251500 [0,0,0,0,0,1|1,0,2]=4 1040 B14R1.716 CCC(=O)\C=C\NCc1ccccc1 Amb24627880 [0,0,0,0,0,1|1,0,2]=4 1041 B14R1.716 CCC(C)COCCc1ccccc1 Amb24100310 [0,0,0,0,0,1|2,0,1]=4 1042 B14R1.716 CCC(C)NCCCc1ccccc1 Amb20673663 [0,0,0,0,0,1|2,0,1]=4 1043 B14R1.716 CCC(O)CCOCc1ccccc1 Amb25317487 [0,0,0,0,0,1|1,0,2]=4 1044 B14R1.716 CCN(C)CCNCc1ccccc1 Amb19079144 [0,0,0,0,0,1|3,0,0]=4 1045 B14R1.716 CC[C@@H](O)CCOCc1ccccc1 Amb25748936 [0,0,0,0,0,1|1,0,2]=4 1046 B14R1.716 CNC(=O)CCC#Cc1ccccc1 Amb25185908 [0,0,0,0,0,1|1,0,1]=3 1047 B14R1.716 CNC(=O)CCNCc1c[n]ccc1 Amb19984984 [0,0,0,0,0,1|2,0,0]=3 1048 B14R1.716 CNC(=O)CCNCc1ccc[n]c1 Amb19079385 [0,0,0,0,0,1|2,0,0]=3 1049 B14R1.716 CNC(=O)CCNCc1ccccc1 Amb18330312 [0,0,0,0,0,1|1,0,0]=2 1050 B14R1.716 CNC(=O)CNOCc1ccccc1 Amb25114481 [0,0,0,0,0,1|2,0,0]=3 1051 B14R1.716 CNC(=O)CSCCc1cc[n]cc1 Amb24303597 [0,0,0,0,0,1|2,0,0]=3 1052 B14R1.716 CNC(=O)CSCCc1cccc[n]1 Amb24303603 [0,0,0,0,0,1|2,0,0]=3 1053 B14R1.716 CNC(=O)N\N=C\Cc1ccccc1 Amb25183663 [0,0,0,0,0,1|2,0,1]=4 1054 B14R1.716 CNC(=O)OCCOc1ccccc1 Amb24081214 [0,0,0,0,0,1|2,0,0]=3 1055 B14R1.716 CNC(=O)\C=N\OCc1ccccc1 Amb24506570 [0,0,0,0,0,1|2,0,1]=4 1056 B14R1.716 CNC(C)CCOCc1ccccc1 Amb19079558 [0,0,0,0,0,1|2,0,1]=4 1057 B14R1.716 COC(=O)C=CN=Nc1ccccc1 Amb22486676 [0,0,0,0,0,1|1,0,2]=4 1058 B14R1.716 COC(=O)CCCCc1cccc[n]1 Amb24113266 [0,0,0,0,0,1|1,0,0]=2 1059 B14R1.716 COC(=O)CCCNc1cc[n]cc1 Amb18933138 [0,0,0,0,0,1|1,0,0]=2 1060 B14R1.716 COC(=O)CCCNc1cccc[n]1 Amb18933129 [0,0,0,0,0,1|1,0,0]=2 1061 B14R1.716 COC(=O)CCCNc1ncccn1 Amb2434810 [0,0,0,0,0,1|2,0,0]=3 1062 B14R1.716 COC(=O)CCCOc1ccccc1 Amb2170599 [0,0,0,0,0,1|0,0,0]=1 1063 B14R1.716 COC(=O)NCC#Cc1ccccc1 Amb24374036 [0,0,0,0,0,1|0,0,2]=3 1064 B14R1.716 COC(=O)NCCOc1ccccc1 Amb1014011 [0,0,0,0,0,1|1,0,0]=2 1065 B14R1.716 COC(=O)N\C=C/Sc1ccccc1 Amb24523797 [0,0,0,0,0,1|1,0,2]=4 1066 B14R1.716 COC(=O)OCC=Cc1ccccc1 Amb22230406 [0,0,0,0,0,1|0,0,2]=3 1067 B14R1.716 COC(=O)\C=C\C#Cc1ccccc1 Amb20001567 [0,0,0,0,0,1|0,0,3]=4 1068 B14R1.716 COC(C)CNOCc1ccccc1 Amb25342923 [0,0,0,0,0,1|2,0,1]=4 1069 B14R1.716 C\C(\CCNCc1ccccc1)=C\C Amb24440553 [0,0,0,0,0,1|2,0,0]=3 1070 B14R1.716 C\C(\CCNCc1ccccc1)=N\O Amb24696355 [0,0,0,0,0,1|3,0,0]=4 1071 B14R1.716 C\N=C(\N)/NCCNc1ccccc1 Amb25318489 [0,0,0,0,0,1|3,0,0]=4 1072 B14R1.716 ClCC(=O)NCCCc1ccccc1 Amb1103589 [0,0,0,0,0,1|2,0,0]=3 1073 B14R1.716 ClCC(=O)NCCSc1ccccc1 Amb1657260 [0,0,0,0,0,1|3,0,0]=4 1074 B14R1.716 NCC(=O)CCOCc1ccccc1 Amb25698053 [0,0,0,0,0,1|2,0,0]=3 1075 B14R1.716 NCC(=O)NCCOc1ccccc1 Amb17235931 [0,0,0,0,0,1|3,0,0]=4 1076 B14R1.716 NCC(=O)NCCSc1ccccc1 Amb24770028 [0,0,0,0,0,1|3,0,0]=4 1077 B14R1.716 NNC(=O)CCCCc1ccccc1 Amb22484620 [0,0,0,0,0,1|2,0,0]=3 1078 B14R1.716 NNC(=O)CCCNc1ccccc1 Amb1007482 [0,0,0,0,0,1|2,0,0]=3 1079 B14R1.716 NNC(=O)CCNCc1ccc[n]c1 Amb20171994 [0,0,0,0,0,1|3,0,0]=4 1080 B14R1.716 NNC(=O)CCNCc1ccccc1 Amb17604772 [0,0,0,0,0,1|2,0,0]=3 1081 B14R1.716 N\C(\CCNCc1ccccc1)=N/O Amb19981283 [0,0,0,0,0,1|3,0,0]=4 1082 B14R1.716 N\C(\CCNCc1ccccc1)=N/O Amb24109264 [0,0,0,0,0,1|3,0,0]=4 1083 B14R1.716 O=C(CBr)CCOCc1ccccc1 Amb25342908 [0,0,0,0,0,1|2,0,0]=3 1084 B14R1.716 O=C(CBr)OCCCc1ccccc1 Amb24094180 [0,0,0,0,0,1|2,0,0]=3 1085 B14R1.716 O=C(CCl)NCOCc1ccccc1 Amb25181342 [0,0,0,0,0,1|3,0,0]=4 1086 B11R1.28 Br[Zn]CCCc1ccccc1 Amb22000503 [2,0,0,0,0,0|2,0,0]=4 1087 B11R1.28 C#CCCCc1ccccc1 Amb10071067 [2,0,0,0,0,0|0,0,2]=4 1088 B11R1.28 C/C=C/CCc1ccccc1 Amb17940149 [2,0,0,0,0,0|0,0,1]=3 1089 B11R1.28 C=CCCCc1ccccc1 Amb24062985 [2,0,0,0,0,0|0,0,1]=3 1090 B11R1.28 C=CCOCc1ccccc1 Amb17933917 [2,0,0,0,0,0|1,0,1]=4 1091 B11R1.28 C=CCSCc1ccccc1 Amb17799426 [2,0,0,0,0,0|1,0,1]=4 1092 B11R1.28 CC=CCCc1cccc[n]1 Amb24100575 [2,0,0,0,0,0|1,0,1]=4 1093 B11R1.28 CC=CCCc1ccccc1 Amb24062987 [2,0,0,0,0,0|0,0,1]=3 1094 B11R1.28 CCCCC[n+]1ccccc1 Amb24754723 [2,0,0,0,0,0|1,0,1]=4 1095 B11R1.28 CCCCCc1cccnc1 Amb17672949 [2,0,0,0,0,0|1,0,1]=4 1096 B11R1.28 CCCCCc1ccncc1 Amb17672950 [2,0,0,0,0,0|1,0,1]=4 1097 B11R1.28 CCCNCc1ccccc1 Amb1105937 [2,0,0,0,0,0|1,0,1]=4 1098 B11R1.28 CCNCCc1ccccc1 Amb2119468 [2,0,0,0,0,0|1,0,1]=4 1099 B11R1.28 CNCCCc1c[n]ccc1 Amb23442716 [2,0,0,0,0,0|2,0,0]=4 1100 B11R1.28 CNCCCc1cc[n]cc1 Amb19025185 [2,0,0,0,0,0|2,0,0]=4 1101 B11R1.28 CNCCCc1cccc[n]1 Amb18312462 [2,0,0,0,0,0|2,0,0]=4 1102 B11R1.28 CNCCCc1ccccc1 Amb21954280 [2,0,0,0,0,0|1,0,0]=3 1103 B11R1.28 CNCCOc1ccccc1 Amb1105525 [2,0,0,0,0,0|2,0,0]=4 1104 B11R1.28 CNCCSc1ccccc1 Amb10608735 [2,0,0,0,0,0|2,0,0]=4 1105 B11R1.28 CNCCSc1ccccc1 Amb17622507 [2,0,0,0,0,0|2,0,0]=4 1106 B11R1.28 COCC#Cc1ccccc1 Amb25308232 [2,0,0,0,0,0|0,0,2]=4 1107 B11R1.28 COCCCc1c[n]ccc1 Amb25382996 [2,0,0,0,0,0|1,0,0]=3 1108 B11R1.28 COCCCc1cc[n]c[n]1 Amb23453461 [2,0,0,0,0,0|2,0,0]=4 1109 B11R1.28 COCCCc1cccc[n]1 Amb25383067 [2,0,0,0,0,0|1,0,0]=3 1110 B11R1.28 COCCNc1c[n]ccc1 Amb18268638 [2,0,0,0,0,0|2,0,0]=4 1111 B11R1.28 COCCOc1c[n]ccc1 Amb25383068 [2,0,0,0,0,0|2,0,0]=4 1112 B11R1.28 COCCOc1cc[n]cc1 Amb25383069 [2,0,0,0,0,0|2,0,0]=4 1113 B11R1.28 COCCOc1cccc[n]1 Amb24070160 [2,0,0,0,0,0|2,0,0]=4 1114 B11R1.28 COCCSc1ccccn1 Amb17760116 [2,0,0,0,0,0|2,0,0]=4 1115 B11R1.28 COCNCc1ccccc1 Amb25053350 [2,0,0,0,0,0|1,0,0]=3 1116 B11R1.28 CONCCc1cccc[n]1 Amb24763045 [2,0,0,0,0,0|2,0,0]=4 1117 B11R1.28 CONCCc1ccccc1 Amb22897018 [2,0,0,0,0,0|1,0,0]=3 1118 B11R1.28 CONCOc1ccccc1 Amb24096695 [2,0,0,0,0,0|2,0,0]=4 1119 B11R1.28 CO\C=C/Oc1ccccc1 Amb24069136 [2,0,0,0,0,0|1,0,1]=4 1120 B11R1.28 CO\C=C\Oc1ccccc1 Amb24069134 [2,0,0,0,0,0|1,0,1]=4 1121 B11R1.28 CSCCCc1cc[n]cc1 Amb25382938 [2,0,0,0,0,0|1,1,0]=4 1122 B11R1.28 CSCCCc1ccccc1 Amb25383748 [2,0,0,0,0,0|0,1,0]=3 1123 B11R1.28 CSCCNc1ccccc1 Amb17307504 [2,0,0,0,0,0|1,1,0]=4 1124 B11R1.28 CSCSCc1ccccc1 Amb25380610 [2,0,0,0,0,0|1,1,0]=4 1125 B11R1.28 C\C=C\CCc1cc[n]cc1 Amb25830692 [2,0,0,0,0,0|1,0,1]=4 1126 B11R1.28 C\C=N\OCc1ccccc1 Amb24334870 [2,0,0,0,0,0|2,0,0]=4 1127 B11R1.28 Cl[Mg]CCCc1ccccc1 Amb19928784 [2,0,0,0,0,0|2,0,0]=4 1128 B11R1.28 ICCCCc1ccccc1 Amb25380384 [2,0,0,0,0,0|1,0,1]=4 1129 B11R1.28 NCCCCc1ccccc1 Amb1227740 [2,0,0,0,0,0|1,0,1]=4 1130 B11R1.28 NCCCCc1ccccc1 Amb19929939 [2,0,0,0,0,0|1,0,1]=4 1131 B11R1.28 NNCCCc1ccccc1 Amb19373221 [2,0,0,0,0,0|2,0,0]=4 1132 B11R1.28 NOCCCc1ccccc1 Amb22231356 [2,0,0,0,0,0|1,0,0]=3 1133 B11R1.28 NOCCCc1ccccn1 Amb17089546 [2,0,0,0,0,0|2,0,0]=4 1134 B11R1.28 NOCCCc1cccnc1 Amb17089547 [2,0,0,0,0,0|2,0,0]=4 1135 B11R1.28 NOCCCc1ccncc1 Amb17089548 [2,0,0,0,0,0|2,0,0]=4 1136 B11R1.28 NOCCNc1ccccc1 Amb24486573 [2,0,0,0,0,0|2,0,0]=4 1137 B11R1.28 NOCCOc1ccccc1 Amb17088287 [2,0,0,0,0,0|2,0,0]=4 1138 B11R1.28 NOCCOc1ccccc1 Amb19894640 [2,0,0,0,0,0|2,0,0]=4 1139 B11R1.28 NOCOCc1ccccc1 Amb10606697 [2,0,0,0,0,0|2,0,0]=4 1140 B11R1.28 O=C=NCCc1ccccc1 Amb2092802 [2,0,0,0,0,0|1,0,1]=4 1141 B11R1.28 O=CC#CCc1ccccc1 Amb25189233 [2,0,0,0,0,0|0,0,2]=4 1142 B11R1.28 O=CCCCc1[n]ccc[n]1 Amb24061342 [2,0,0,0,0,0|2,0,0]=4 1143 B11R1.28 O=CCCCc1c[n]c[n]c1 Amb24063015 [2,0,0,0,0,0|2,0,0]=4 1144 B11R1.28 O=CCCCc1c[n]ccc1 Amb24099514 [2,0,0,0,0,0|1,0,0]=3 1145 B11R1.28 O=CCCCc1cc[n]c[n]1 Amb24099617 [2,0,0,0,0,0|2,0,0]=4 1146 B11R1.28 O=CCCCc1cc[n]cc1 Amb24099515 [2,0,0,0,0,0|1,0,0]=3 1147 B11R1.28 O=CCCCc1cccc[n]1 Amb22897023 [2,0,0,0,0,0|1,0,0]=3 1148 B11R1.28 O=CCCOc1cccc[n]1 Amb24762999 [2,0,0,0,0,0|2,0,0]=4 1149 B11R1.28 O=CCCSc1cccc[n]1 Amb18177861 [2,0,0,0,0,0|2,0,0]=4 1150 B11R1.28 O=CCCSc1ccccc1 Amb17082943 [2,0,0,0,0,0|1,0,0]=3 1151 B11R1.28 O=CCNCc1ccccc1 Amb19886524 [2,0,0,0,0,0|1,0,0]=3 1152 B11R1.28 O=CCONc1ccccc1 Amb24434643 [2,0,0,0,0,0|2,0,0]=4 1153 B11R1.28 O=CCSCc1cc[n]cc1 Amb25383559 [2,0,0,0,0,0|2,0,0]=4 1154 B11R1.28 O=CCSCc1ccccc1 Amb18801121 [2,0,0,0,0,0|1,0,0]=3 1155 B11R1.28 O=CC\C=C\c1ccccc1 Amb18644267 [2,0,0,0,0,0|0,0,2]=4 1156 B11R1.28 O=CNCCc1c[n]ccc1 Amb24592209 [2,0,0,0,0,0|2,0,0]=4 1157 B11R1.28 O=CNCCc1cc[n]cc1 Amb24371433 [2,0,0,0,0,0|2,0,0]=4 1158 B11R1.28 O=CNCCc1ccccc1 Amb10559023 [2,0,0,0,0,0|1,0,0]=3 1159 B11R1.28 O=CNCSc1ccccc1 Amb24382608 [2,0,0,0,0,0|2,0,0]=4 1160 B11R1.28 O=C\C=C\Cc1ccccc1 Amb18124787 [2,0,0,0,0,0|0,0,2]=4 1161 B11R1.28 OCCCCc1c[n]ccc1 Amb22732495 [2,0,0,0,0,0|1,0,1]=4 1162 B11R1.28 OCCCCc1cccc[n]1 Amb21520414 [2,0,0,0,0,0|1,0,1]=4 1163 B11R1.28 OCCCCc1ccncc1 Amb17740015 [2,0,0,0,0,0|1,0,1]=4 1164 B11R1.28 OCCCNc1ccccc1 Amb17307125 [2,0,0,0,0,0|1,0,1]=4 1165 B11R1.28 OCCCNc1ccccc1 Amb17772314 [2,0,0,0,0,0|1,0,1]=4 1166 B11R1.28 OCCNCc1ccccc1 Amb1835287 [2,0,0,0,0,0|1,0,1]=4 1167 B11R1.28 ONCCOc1ccccc1 Amb17088413 [2,0,0,0,0,0|2,0,0]=4 1168 B11R1.28 SCCCCc1ccccc1 Amb17400224 [2,0,0,0,0,0|0,1,1]=4 1169 B11R1.28 [NH3+]CCCCc1ccccc1 Amb22733934 [2,0,0,0,0,0|1,0,1]=4 1170 B11R1.28 [NH3+]OCCOc1ccccc1 Amb2420800 [2,0,0,0,0,0|2,0,0]=4 1171 B13R1.6 CCCCCCc1cccc(c1)Br Amb10808077 [1,1,0,0,0,0|1,0,1]=4 1172 B13R1.6 COCCCOc1cccc(c1)Br Amb17257506 [1,1,0,0,0,0|1,0,1]=4 1173 B13R1.6 COCCNCc1cccc(Cl)c1 Amb21972172 [1,1,0,0,0,0|1,0,1]=4 1174 B13R1.6 COCCNCc1cccc(c1)Br Amb1836612 [1,1,0,0,0,0|1,0,1]=4 1175 B13R1.6 COCCNCc1cccc(c1)C Amb1836810 [1,1,0,0,0,0|1,0,1]=4 1176 B13R1.6 COCCNCc1cccc(c1)O Amb1836877 [1,1,0,0,0,0|1,0,1]=4 1177 B13R1.6 COCCOCc1cc(Br)ccc1 Amb22058978 [1,1,0,0,0,0|1,0,1]=4 1178 B13R1.6 COCOCCc1cc(F)ccc1 Amb22641541 [1,1,0,0,0,0|1,0,1]=4 1179 B13R1.6 C\C=C\CCNc1cccc(N)c1 Amb24693671 [1,1,0,0,0,0|2,0,0]=4 1180 B13R1.9 CCCCCCc1ccc(I)cc1 Amb22043588 [1,1,0,0,0,0|1,0,1]=4 1181 B13R1.9 COCCCOc1ccc(cc1)Br Amb17257507 [1,1,0,0,0,0|1,0,1]=4 1182 B13R1.9 COCCCSc1ccc(N)cc1 Amb18321735 [1,1,0,0,0,0|1,0,1]=4 1183 B13R1.9 COCCNCc1ccc(F)cc1 Amb22586767 [1,1,0,0,0,0|1,0,1]=4 1184 B13R1.9 COCCNCc1ccc(cc1)Br Amb1836428 [1,1,0,0,0,0|1,0,1]=4 1185 B13R1.9 COCCNCc1ccc(cc1)C Amb1836071 [1,1,0,0,0,0|1,0,1]=4 1186 B13R1.9 COCCNCc1ccc(cc1)Cl Amb13949021 [1,1,0,0,0,0|1,0,1]=4 1187 B13R1.9 COCCNCc1ccc(cc1)Cl Amb1836723 [1,1,0,0,0,0|1,0,1]=4 1188 B13R1.9 COCCNCc1ccc(cc1)F Amb1835648 [1,1,0,0,0,0|1,0,1]=4 1189 B13R1.9 COCCNCc1ccc(cc1)O Amb1836498 [1,1,0,0,0,0|1,0,1]=4 1190 B13R1.9 COCCOCc1ccc(Br)cc1 Amb19373739 [1,1,0,0,0,0|1,0,1]=4 1191 B13R1.9 COCOCCc1ccc(F)cc1 Amb22641545 [1,1,0,0,0,0|1,0,1]=4 1192 B13R1.24 CC#CCCC(O)c1ccccc1 Amb18804027 [1,1,0,0,0,0|1,0,1]=4 1193 B13R1.24 CCCCC[C@@H](N)c1ccccc1 Amb22288650 [1,1,0,0,0,0|1,0,1]=4 1194 B13R1.28 BrC\C=C\COCc1ccccc1 Amb25180905 [1,1,0,0,0,0|2,0,0]=4 1195 B13R1.28 CC=C=CCNCc1ccccc1 Amb25073248 [1,1,0,0,0,0|2,0,0]=4 1196 B13R1.28 CCCCNCCc1ccccc1 Amb2172322 [1,1,0,0,0,0|1,0,1]=4 1197 B13R1.28 CCCCOCCc1ccccc1 Amb24065444 [1,1,0,0,0,0|1,0,1]=4 1198 B13R1.28 CCCNCCCc1ccccc1 Amb20673529 [1,1,0,0,0,0|1,0,1]=4 1199 B13R1.28 CCCOCCCc1ccccc1 Amb24063573 [1,1,0,0,0,0|1,0,1]=4 1200 B13R1.28 CCNCCNCc1ccccc1 Amb18809112 [1,1,0,0,0,0|2,0,0]=4 1201 B13R1.28 CCSCCCSc1ccccc1 Amb10669604 [1,1,0,0,0,0|2,0,0]=4 1202 B13R1.28 CCSCCNCc1ccccc1 Amb19064371 [1,1,0,0,0,0|2,0,0]=4 1203 B13R1.28 CNCCCCOc1ccccc1 Amb17309029 [1,1,0,0,0,0|1,0,1]=4 1204 B13R1.28 CNCCCNCc1ccccc1 Amb18186267 [1,1,0,0,0,0|1,0,1]=4 1205 B13R1.28 CNCCCOCc1ccccc1 Amb18186412 [1,1,0,0,0,0|1,0,1]=4 1206 B13R1.28 CNCCNCCc1ccccc1 Amb20140448 [1,1,0,0,0,0|1,0,1]=4 1207 B13R1.28 COCCCNCc1ccccc1 Amb2172436 [1,1,0,0,0,0|0,0,1]=3 1208 B13R1.28 COCCNCCc1ccccc1 Amb2119876 [1,1,0,0,0,0|0,0,1]=3 1209 B13R1.28 COCCNCCc1ccncc1 Amb16191750 [1,1,0,0,0,0|1,0,1]=4 1210 B13R1.28 COCCONCc1ccccc1 Amb25765381 [1,1,0,0,0,0|1,0,1]=4 1211 B13R1.28 CSSCCNCc1ccccc1 Amb24466659 [1,1,0,0,0,0|1,1,0]=4 1212 B13R1.28 C\C=C\CCNCc1ccccc1 Amb10601621 [1,1,0,0,0,0|1,0,0]=3 1213 B13R1.28 C\C=C\CNOCc1ccccc1 Amb25088761 [1,1,0,0,0,0|2,0,0]=4 1214 B13R1.28 ClCCCCCCc1ccccc1 Amb10807864 [1,1,0,0,0,0|1,0,1]=4 1215 B13R1.28 ClC\C=C/COCc1ccccc1 Amb25258321 [1,1,0,0,0,0|2,0,0]=4 1216 B13R1.28 NCCCCCCc1ccccc1 Amb17233312 [1,1,0,0,0,0|1,0,1]=4 1217 B13R1.28 NCCCCCCc1ccccc1 Amb17619338 [1,1,0,0,0,0|1,0,1]=4 1218 B13R1.28 NCCNCCCc1ccccc1 Amb17091041 [1,1,0,0,0,0|2,0,0]=4 1219 B13R1.28 NOCCCOCc1ccccc1 Amb25144104 [1,1,0,0,0,0|1,0,1]=4 1220 B13R1.28 OC\C=C\CNCc1ccccc1 Amb18648063 [1,1,0,0,0,0|2,0,0]=4 1221 B13R1.28 O\N=C\CCOCc1ccccc1 Amb2228260 [1,1,0,0,0,0|2,0,0]=4 1222 B13R1.28 [NH3+]CCCCCCc1ccccc1 Amb22729464 [1,1,0,0,0,0|1,0,1]=4 1223 B13R1.42 CC#CC(CCc1ccccc1)O Amb17619341 [1,1,0,0,0,0|1,0,1]=4 1224 B13R1.42 CC#CC(Cl)CCc1ccccc1 Amb25779974 [1,1,0,0,0,0|1,0,1]=4 1225 B13R1.42 CC#C[C@H](O)CCc1ccccc1 Amb25763952 [1,1,0,0,0,0|1,0,1]=4 1226 B13R1.42 CCCC(O)CCc1ccccc1 Amb18796052 [1,1,0,0,0,0|1,0,1]=4 1227 B13R1.42 COCC(=O)CCc1ccccc1 Amb10563175 [1,1,0,0,0,0|0,0,2]=4 1228 B13R1.42 CONC(=O)CCc1ccccc1 Amb10705059 [1,1,0,0,0,0|1,0,1]=4 1229 B13R1.42 C\C=C\C(C)NCc1ccccc1 Amb24355890 [1,1,0,0,0,0|2,0,0]=4 1230 B13R1.42 C\C=C\[C@@H](C)NCc1ccccc1 Amb25350237 [1,1,0,0,0,0|2,0,0]=4 1231 B13R1.44 CC#CCC(N)Cc1ccccc1 Amb18183777 [1,1,0,0,0,0|1,0,1]=4 1232 B13R1.44 CC#CCC(O)Cc1ccccc1 Amb18183851 [1,1,0,0,0,0|1,0,1]=4 1233 B13R1.337 CC(=C)\C=C\CCc1ccccc1 Amb22546754 [1,1,0,0,0,0|1,0,1]=4 1234 B13R1.337 CC(C)=CCOCc1ccccc1 Amb25045065 [1,1,0,0,0,0|2,0,0]=4 1235 B13R1.337 CC(NCCCc1ccccc1)C Amb2097980 [1,1,0,0,0,0|2,0,0]=4 1236 B13R1.337 C\C(=C/CNCc1ccccc1)\Cl Amb1811425 [1,1,0,0,0,0|2,0,0]=4 1237 B13R1.555 CCNCCCc1ccccc1Cl Amb18331009 [1,1,0,0,0,0|2,0,0]=4 1238 B13R1.555 COCCCOc1ccccc1Br Amb17257505 [1,1,0,0,0,0|1,0,1]=4 1239 B13R1.555 COCCNCc1ccccc1C Amb17622504 [1,1,0,0,0,0|1,0,1]=4 1240 B13R1.555 COCCNCc1ccccc1Cl Amb13949020 [1,1,0,0,0,0|1,0,1]=4 1241 B13R1.555 COCCNCc1ccccc1F Amb1836065 [1,1,0,0,0,0|1,0,1]=4 1242 B13R1.555 COCCNCc1ccccc1O Amb1836923 [1,1,0,0,0,0|1,0,1]=4 1243 B13R1.555 COCOCCc1ccccc1F Amb22641546 [1,1,0,0,0,0|1,0,1]=4 1244 B13R1.45 CC(=CCC(C)=O)c1ccccc1 Amb24090254 [1,1,0,0,0,0|0,0,2]=4 1245 B13R1.45 CC(=O)C=CC(C)c1ccccc1 Amb24090253 [1,1,0,0,0,0|0,0,2]=4 1246 B13R1.45 CC(=O)CCC(c1ccccn1)Cl Amb17402226 [1,1,0,0,0,0|1,0,0]=3 1247 B13R1.45 CC(=O)CCC(c1cccnc1)Cl Amb17402227 [1,1,0,0,0,0|1,0,0]=3 1248 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [1,1,0,0,0,0|1,0,1]=4 1249 B13R1.45 CC(=O)NCC(C)c1cc[n]cc1 Amb25167442 [1,1,0,0,0,0|2,0,0]=4 1250 B13R1.45 CC(=O)NCC(O)c1ccc[n]c1 Amb25091917 [1,1,0,0,0,0|2,0,0]=4 1251 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 Amb25311245 [1,1,0,0,0,0|1,0,0]=3 1252 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 Amb24435357 [1,1,0,0,0,0|1,0,0]=3 1253 B13R1.45 CC(=O)NC[C@H](N)c1ccccc1 Amb25752007 [1,1,0,0,0,0|1,0,0]=3 1254 B13R1.45 CC(=O)NNC(C)c1ccccc1 Amb24573888 [1,1,0,0,0,0|2,0,0]=4 1255 B13R1.45 CC(=O)OCC(=C)c1ccccc1 Amb17778927 [1,1,0,0,0,0|1,0,1]=4 1256 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb25292084 [1,1,0,0,0,0|0,0,2]=4 1257 B13R1.45 CC(=O)\C=C\C(O)c1ccccc1 Amb25318863 [1,1,0,0,0,0|0,0,2]=4 1258 B13R1.45 CC(=O)\C=C\[C@H](C)c1ccccc1 Amb25059669 [1,1,0,0,0,0|0,0,2]=4 1259 B13R1.45 CC(C)=CC[C@@H](N)c1ccccc1 Amb25188074 [1,1,0,0,0,0|1,0,1]=4 1260 B13R1.45 CC(C)=NCC(O)c1ccccc1 Amb25670758 [1,1,0,0,0,0|2,0,0]=4 1261 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [1,1,0,0,0,0|2,0,0]=4 1262 B13R1.45 CC(SCC(O)=O)c1ccccc1 Amb22275729 [1,1,0,0,0,0|1,0,0]=3 1263 B13R1.45 CC(\N=C\C(O)=O)c1ccccc1 Amb24545007 [1,1,0,0,0,0|1,0,1]=4 1264 B13R1.45 CC(c1ccccc1)NCC(=O)N Amb1114995 [1,1,0,0,0,0|2,0,0]=4 1265 B13R1.45 CN(C)CCC(Cl)c1ccccc1 Amb22754498 [1,1,0,0,0,0|2,0,0]=4 1266 B13R1.45 CN(C)CC[C@@H](O)c1ccccc1 Amb24181885 [1,1,0,0,0,0|2,0,0]=4 1267 B13R1.45 CN(CCC(O)=O)c1cc[n]cc1 Amb24271265 [1,1,0,0,0,0|2,0,0]=4 1268 B13R1.45 CN(CCC(O)=O)c1cccc[n]1 Amb18669639 [1,1,0,0,0,0|2,0,0]=4 1269 B13R1.45 CN(CCC(O)=O)c1ccccc1 Amb19373406 [1,1,0,0,0,0|1,0,0]=3 1270 B13R1.45 CN(c1ccccc1)CCC(=O)Cl Amb17143181 [1,1,0,0,0,0|2,0,0]=4 1271 B13R1.45 CN(c1ccccc1)CCC(=O)N Amb17142975 [1,1,0,0,0,0|2,0,0]=4 1272 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [1,1,0,0,0,0|2,0,0]=4 1273 B13R1.45 C[C@@H](NCC(O)=O)c1ccccc1 Amb17935709 [1,1,0,0,0,0|1,0,0]=3 1274 B13R1.45 C[C@H](C#CC(O)=O)c1ccccc1 Amb24390872 [1,1,0,0,0,0|0,0,2]=4 1275 B13R1.45 C[C@H](NCC(O)=O)c1ccccc1 Amb17935708 [1,1,0,0,0,0|1,0,0]=3 1276 B13R1.45 C\C(=C/CC(O)=O)\c1ccccc1 Amb25189805 [1,1,0,0,0,0|0,0,2]=4 1277 B13R1.45 C\C(=C\CC(C)=O)\c1ccccc1 Amb24392921 [1,1,0,0,0,0|0,0,2]=4 1278 B13R1.45 C\C(=N\CC(O)=O)\c1ccccc1 Amb25294322 [1,1,0,0,0,0|1,0,1]=4 1279 B13R1.45 C\C(\Cl)=C\CC(O)c1ccccc1 Amb24752308 [1,1,0,0,0,0|1,0,1]=4 1280 B13R1.45 ClC(c1ccccc1)CCC(=O)C Amb17402167 [1,1,0,0,0,0|0,0,0]=2 1281 B13R1.45 ClC(c1ccncc1)CCC(=O)C Amb17402228 [1,1,0,0,0,0|1,0,0]=3 1282 B13R1.45 NC(=O)CCC(c1ccccn1)O Amb17335401 [1,1,0,0,0,0|2,0,0]=4 1283 B13R1.45 NC(=O)CCC(c1cccnc1)O Amb17335403 [1,1,0,0,0,0|2,0,0]=4 1284 B13R1.45 NC(CCC(O)=O)c1ccccc1 Amb19514853 [1,1,0,0,0,0|0,0,0]=2 1285 B13R1.45 NC(c1ccccc1)CCN(C)C Amb13949100 [1,1,0,0,0,0|2,0,0]=4 1286 B13R1.45 NN(CCC(O)=O)c1ccccc1 Amb19861024 [1,1,0,0,0,0|1,0,0]=3 1287 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb22745911 [1,1,0,0,0,0|0,0,0]=2 1288 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb23399581 [1,1,0,0,0,0|0,0,0]=2 1289 B13R1.45 O=C(c1ccccc1)CCC(=O)N Amb17233256 [1,1,0,0,0,0|1,0,1]=4 1290 B13R1.45 O=C(c1ccccc1)CCC(=O)O Amb1224638 [1,1,0,0,0,0|0,0,1]=3 1291 B13R1.45 O=C(c1ccccc1)CNC(=O)C Amb17335159 [1,1,0,0,0,0|1,0,1]=4 1292 B13R1.45 O=C(c1ccccc1)NCC(=O)O Amb1006961 [1,1,0,0,0,0|1,0,1]=4 1293 B13R1.45 O=C(c1ccccc1)NCC(=O)O Amb17616813 [1,1,0,0,0,0|1,0,1]=4 1294 B13R1.45 O=C(c1ccccc1)OCC(=O)O Amb17594607 [1,1,0,0,0,0|1,0,1]=4 1295 B13R1.45 OC(=O)C#CC(O)c1ccccc1 Amb24355315 [1,1,0,0,0,0|0,0,2]=4 1296 B13R1.45 OC(=O)CCC(=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22054406 [1,1,0,0,0,0|0,0,1]=3 1297 B13R1.45 OC(=O)CCC(=O)c1c[n]ccc1 Amb22490879 [1,1,0,0,0,0|1,0,1]=4 1298 B13R1.45 OC(=O)CCC(=O)c1cccnc1 Amb1091971 [1,1,0,0,0,0|1,0,1]=4 1299 B13R1.45 OC(=O)CCC(O)c1c[n]ccc1 Amb18805211 [1,1,0,0,0,0|1,0,0]=3 1300 B13R1.45 OC(=O)CCC(O)c1cc[n]cc1 Amb18193342 [1,1,0,0,0,0|1,0,0]=3 1301 B13R1.45 OC(=O)CCC(O)c1cccc[n]1 Amb18824244 [1,1,0,0,0,0|1,0,0]=3 1302 B13R1.45 OC(=O)CNC(=O)c1ccccc1 Amb1197580 [1,1,0,0,0,0|1,0,1]=4 1303 B13R1.45 OC(=O)CNC(=S)c1ccccc1 Amb24309476 [1,1,0,0,0,0|1,0,1]=4 1304 B13R1.45 OC(=O)\C=C\C(O)c1ccccc1 Amb18128124 [1,1,0,0,0,0|0,0,2]=4 1305 B13R1.45 OC(c1ccccc1)CCC(=O)N Amb17335290 [1,1,0,0,0,0|1,0,0]=3 1306 B13R1.45 OC(c1ccccc1)COC(=O)N Amb17594650 [1,1,0,0,0,0|2,0,0]=4 1307 B13R1.45 OC(c1ccncc1)CCC(=O)N Amb17335405 [1,1,0,0,0,0|2,0,0]=4 1308 B13R1.45 [O-]C(=O)CCC(c1cccnc1)O Amb17619701 [1,1,0,0,0,0|1,0,1]=4 1309 B13R1.45 [O-]C(=O)CC[13CH](O)[13c]1[13cH][n][13cH][13cH][13cH]1 Amb22056115 [1,1,0,0,0,0|1,0,1]=4 1310 B13R1.149 BrC(=C)CCCc1cccc(c1)C Amb13890668 [1,1,0,0,0,0|1,0,1]=4 1311 B13R1.149 BrC(=C)CCCc1cccc(c1)Cl Amb13890656 [1,1,0,0,0,0|1,0,1]=4 1312 B13R1.149 BrC(=C)CCCc1cccc(c1)F Amb13890680 [1,1,0,0,0,0|1,0,1]=4 1313 B13R1.149 CC(=C)CCCc1cccc(c1)C Amb13890669 [1,1,0,0,0,0|1,0,0]=3 1314 B13R1.149 CC(=C)CCCc1cccc(c1)Cl Amb13890657 [1,1,0,0,0,0|1,0,0]=3 1315 B13R1.149 CC(=C)CCCc1cccc(c1)F Amb13890681 [1,1,0,0,0,0|1,0,0]=3 1316 B13R1.149 CC(=C)CCNc1cccc(Br)c1 Amb25047963 [1,1,0,0,0,0|2,0,0]=4 1317 B13R1.149 CC(=C)CCNc1cccc(Cl)c1 Amb24533539 [1,1,0,0,0,0|2,0,0]=4 1318 B13R1.149 CC(=C)CCNc1cccc(F)c1 Amb24705980 [1,1,0,0,0,0|2,0,0]=4 1319 B13R1.149 CC(=C)CNCc1cccc(Br)c1 Amb24768741 [1,1,0,0,0,0|2,0,0]=4 1320 B13R1.149 CC(=N)NCCc1cccc(Br)c1 Amb24339580 [1,1,0,0,0,0|2,0,0]=4 1321 B13R1.149 CC(=O)CCCc1cccc(c1)Br Amb17255477 [1,1,0,0,0,0|0,0,0]=2 1322 B13R1.149 CC(=O)CCCc1cccc(c1)C Amb17233199 [1,1,0,0,0,0|0,0,0]=2 1323 B13R1.149 CC(=O)CCCc1cccc(c1)Cl Amb17236502 [1,1,0,0,0,0|0,0,0]=2 1324 B13R1.149 CC(=O)CCOc1cccc(c1)Cl Amb17139724 [1,1,0,0,0,0|1,0,0]=3 1325 B13R1.149 CC(=O)C\C=C\c1cccc(Cl)c1 Amb25842151 [1,1,0,0,0,0|0,0,2]=4 1326 B13R1.149 CC(=O)C\C=C\c1cccc(F)c1 Amb24731445 [1,1,0,0,0,0|0,0,2]=4 1327 B13R1.149 CC(=O)NCCc1c[n]cc(O)c1 Amb25687749 [1,1,0,0,0,0|2,0,0]=4 1328 B13R1.149 CC(=O)NCCc1cccc(Cl)c1 Amb17791605 [1,1,0,0,0,0|1,0,0]=3 1329 B13R1.149 CC(=O)NCCc1cccc(F)c1 Amb24476175 [1,1,0,0,0,0|1,0,0]=3 1330 B13R1.149 CC(=O)NNCc1cc(N)ccc1 Amb25258036 [1,1,0,0,0,0|2,0,0]=4 1331 B13R1.149 CC(=O)NOCc1cccc(Cl)c1 Amb25687680 [1,1,0,0,0,0|2,0,0]=4 1332 B13R1.149 CC(=O)NOCc1cccc(F)c1 Amb25106612 [1,1,0,0,0,0|2,0,0]=4 1333 B13R1.149 CC(C)=CCCc1cc(C)ccc1 Amb22227609 [1,1,0,0,0,0|1,0,1]=4 1334 B13R1.149 CC(CCCc1cccc(c1)Br)N Amb17255966 [1,1,0,0,0,0|1,0,1]=4 1335 B13R1.149 CC(CCCc1cccc(c1)C)N Amb17233314 [1,1,0,0,0,0|1,0,1]=4 1336 B13R1.149 CC(CCCc1cccc(c1)Cl)N Amb17236682 [1,1,0,0,0,0|1,0,1]=4 1337 B13R1.149 CN(CCCc1cccc(c1)N)C Amb17050706 [1,1,0,0,0,0|2,0,0]=4 1338 B13R1.149 CS(=O)CCNc1cccc(I)c1 Amb24586043 [1,1,0,0,0,0|2,0,0]=4 1339 B13R1.149 CS(=O)CCNc1cccc(N)c1 Amb25073066 [1,1,0,0,0,0|2,0,0]=4 1340 B13R1.149 Cc1[n]c(CCCC(O)=O)cc[n]1 Amb18193848 [1,1,0,0,0,0|2,0,0]=4 1341 B13R1.149 Cc1c[n]cc(CCCC(O)=O)[n]1 Amb18824524 [1,1,0,0,0,0|2,0,0]=4 1342 B13R1.149 Cc1cc(CCCC(O)=O)[n]c[n]1 Amb18193940 [1,1,0,0,0,0|2,0,0]=4 1343 B13R1.149 Cc1cc(CCNC(N)=O)ccc1 Amb18804769 [1,1,0,0,0,0|2,0,0]=4 1344 B13R1.149 Cc1cc(CNCC(O)=O)ccc1 Amb19341149 [1,1,0,0,0,0|1,0,0]=3 1345 B13R1.149 Cc1cc(NCCC(=O)O)ncc1 Amb10597603 [1,1,0,0,0,0|2,0,0]=4 1346 B13R1.149 Cc1cc(ccc1)C#CCC(O)=O Amb24494657 [1,1,0,0,0,0|0,0,2]=4 1347 B13R1.149 Cc1cc[n]c(CCCC(O)=O)[n]1 Amb18862970 [1,1,0,0,0,0|2,0,0]=4 1348 B13R1.149 Cc1cccc(NCCC(O)=O)[n]1 Amb18128691 [1,1,0,0,0,0|2,0,0]=4 1349 B13R1.149 Cc1cccc(c1)NCCC(C)=C Amb25673699 [1,1,0,0,0,0|2,0,0]=4 1350 B13R1.149 Cc1cccc(c1)\C=C\CC(C)=O Amb24760567 [1,1,0,0,0,0|0,0,2]=4 1351 B13R1.149 ClC(=C)CCCc1cccc(c1)C Amb13890667 [1,1,0,0,0,0|1,0,1]=4 1352 B13R1.149 ClC(=C)CCCc1cccc(c1)Cl Amb13890655 [1,1,0,0,0,0|1,0,1]=4 1353 B13R1.149 ClC(=C)CCCc1cccc(c1)F Amb13890679 [1,1,0,0,0,0|1,0,1]=4 1354 B13R1.149 ClC(=O)CCSc1cccc(c1)C Amb17143636 [1,1,0,0,0,0|2,0,0]=4 1355 B13R1.149 NC(=O)CCSc1cccc(c1)C Amb17143163 [1,1,0,0,0,0|2,0,0]=4 1356 B13R1.149 NC(=O)CCSc1cccc(c1)Cl Amb17143659 [1,1,0,0,0,0|2,0,0]=4 1357 B13R1.149 NC(=O)CSCc1cccc(c1)Br Amb1234290 [1,1,0,0,0,0|2,0,0]=4 1358 B13R1.149 NC(=O)NCCc1cccc(Br)c1 Amb24339582 [1,1,0,0,0,0|2,0,0]=4 1359 B13R1.149 NC(=O)NCCc1cccc(Cl)c1 Amb25079869 [1,1,0,0,0,0|2,0,0]=4 1360 B13R1.149 NC(=O)NCCc1cccc(O)c1 Amb24430516 [1,1,0,0,0,0|2,0,0]=4 1361 B13R1.149 Nc1cc(COCC(O)=O)ccc1 Amb23569203 [1,1,0,0,0,0|1,0,0]=3 1362 B13R1.149 Nc1cc(ccc1)C#CCC(O)=O Amb25330991 [1,1,0,0,0,0|0,0,2]=4 1363 B13R1.149 Nc1cc(ccc1)SCCC(O)=O Amb19662090 [1,1,0,0,0,0|1,0,0]=3 1364 B13R1.149 Nc1cccc(CCNC(N)=O)c1 Amb25765043 [1,1,0,0,0,0|2,0,0]=4 1365 B13R1.149 Nc1cccc(COCC(N)=O)c1 Amb23569204 [1,1,0,0,0,0|2,0,0]=4 1366 B13R1.149 Nc1cccc(NCCC(O)=O)[n]1 Amb24346685 [1,1,0,0,0,0|2,0,0]=4 1367 B13R1.149 OC(=O)C#CCc1cc(F)ccc1 Amb25039653 [1,1,0,0,0,0|0,0,2]=4 1368 B13R1.149 OC(=O)CC=Cc1cccc(F)c1 Amb20622489 [1,1,0,0,0,0|0,0,2]=4 1369 B13R1.149 OC(=O)CCCc1cccc(c1)N Amb10603728 [1,1,0,0,0,0|0,0,0]=2 1370 B13R1.149 OC(=O)CCCc1cccc(c1)N Amb17335328 [1,1,0,0,0,0|0,0,0]=2 1371 B13R1.149 OC(=O)CCCc1cccc(c1)S Amb17616853 [1,1,0,0,0,0|0,0,0]=2 1372 B13R1.149 OC(=O)CCNc1c[n]cc(Br)c1 Amb23510113 [1,1,0,0,0,0|2,0,0]=4 1373 B13R1.149 OC(=O)CCNc1cc(Br)cc[n]1 Amb24769756 [1,1,0,0,0,0|2,0,0]=4 1374 B13R1.149 OC(=O)CCNc1cccc(Br)[n]1 Amb18135525 [1,1,0,0,0,0|2,0,0]=4 1375 B13R1.149 OC(=O)CCNc1cccc(Cl)[n]1 Amb18130766 [1,1,0,0,0,0|2,0,0]=4 1376 B13R1.149 OC(=O)CCNc1cccc(F)[n]1 Amb24406487 [1,1,0,0,0,0|2,0,0]=4 1377 B13R1.149 OC(=O)CCNc1cccc(c1)C Amb2209157 [1,1,0,0,0,0|1,0,0]=3 1378 B13R1.149 OC(=O)CCNc1cccc(c1)Cl Amb2209166 [1,1,0,0,0,0|1,0,0]=3 1379 B13R1.149 OC(=O)CCNc1cccc(c1)F Amb2209162 [1,1,0,0,0,0|1,0,0]=3 1380 B13R1.149 OC(=O)CCOc1cccc(c1)Br Amb15755 [1,1,0,0,0,0|1,0,0]=3 1381 B13R1.149 OC(=O)CCOc1cccc(c1)C Amb1102786 [1,1,0,0,0,0|1,0,0]=3 1382 B13R1.149 OC(=O)CCOc1cccc(c1)Cl Amb1116710 [1,1,0,0,0,0|1,0,0]=3 1383 B13R1.149 OC(=O)CCOc1cccc(c1)F Amb1114548 [1,1,0,0,0,0|1,0,0]=3 1384 B13R1.149 OC(=O)CNCc1cc[n]c(Br)c1 Amb21861857 [1,1,0,0,0,0|2,0,0]=4 1385 B13R1.149 OC(=O)CNCc1cccc(c1)Br Amb1111229 [1,1,0,0,0,0|1,0,0]=3 1386 B13R1.149 OC(=O)CNCc1cccc(c1)C Amb1110883 [1,1,0,0,0,0|1,0,0]=3 1387 B13R1.149 OC(=O)CNCc1cccc(c1)Cl Amb17598410 [1,1,0,0,0,0|1,0,0]=3 1388 B13R1.149 OC(=O)CNCc1cccc(c1)F Amb10609867 [1,1,0,0,0,0|1,0,0]=3 1389 B13R1.149 OC(=O)CNCc1cccc(c1)F Amb2372412 [1,1,0,0,0,0|1,0,0]=3 1390 B13R1.149 OC(=O)COCc1cccc(c1)Br Amb17472946 [1,1,0,0,0,0|1,0,0]=3 1391 B13R1.149 OC(=O)COCc1cccc(c1)C Amb17470624 [1,1,0,0,0,0|1,0,0]=3 1392 B13R1.149 OC(=O)COCc1cccc(c1)Cl Amb17470999 [1,1,0,0,0,0|1,0,0]=3 1393 B13R1.149 OC(=O)CSCc1cccc(c1)Cl Amb1546534 [1,1,0,0,0,0|1,0,0]=3 1394 B13R1.149 OC(=O)CSCc1cccc(c1)F Amb1137816 [1,1,0,0,0,0|1,0,0]=3 1395 B13R1.149 OC(=O)C\C=C\c1cccc(Br)c1 Amb23441782 [1,1,0,0,0,0|0,0,2]=4 1396 B13R1.149 OC(=O)C\C=C\c1cccc(Cl)c1 Amb23441780 [1,1,0,0,0,0|0,0,2]=4 1397 B13R1.149 OC(=O)C\C=C\c1cccc(F)c1 Amb23441778 [1,1,0,0,0,0|0,0,2]=4 1398 B13R1.149 Oc1[n]c(CCCC(O)=O)cc[n]1 Amb18192777 [1,1,0,0,0,0|2,0,0]=4 1399 B13R1.149 Oc1cc(CCCC(O)=O)[n]c[n]1 Amb18224737 [1,1,0,0,0,0|2,0,0]=4 1400 B13R1.149 Oc1cc[n]c(CCCC(O)=O)[n]1 Amb18863008 [1,1,0,0,0,0|2,0,0]=4 1401 B13R1.149 Oc1cccc(CCCC(O)=O)c1 Amb22490497 [1,1,0,0,0,0|0,0,0]=2 1402 B13R1.149 Oc1cccc(c1)OCCC(O)=O Amb18192782 [1,1,0,0,0,0|1,0,0]=3 1403 B13R1.158 BrC(=C)CCCc1ccccc1C Amb13890664 [1,1,0,0,0,0|1,0,1]=4 1404 B13R1.158 CC(=C)CCCc1ccccc1C Amb13890665 [1,1,0,0,0,0|1,0,0]=3 1405 B13R1.158 CC(=C)CCNc1ccccc1Br Amb25161292 [1,1,0,0,0,0|2,0,0]=4 1406 B13R1.158 CC(=C)CCNc1ccccc1F Amb24430251 [1,1,0,0,0,0|2,0,0]=4 1407 B13R1.158 CC(=C)CCNc1ccccc1I Amb24402659 [1,1,0,0,0,0|2,0,0]=4 1408 B13R1.158 CC(=C)CNCc1ccccc1Br Amb24768742 [1,1,0,0,0,0|2,0,0]=4 1409 B13R1.158 CC(=N)NCCc1ccccc1F Amb25316705 [1,1,0,0,0,0|2,0,0]=4 1410 B13R1.158 CC(=O)CCCc1ccccc1C Amb17233198 [1,1,0,0,0,0|0,0,0]=2 1411 B13R1.158 CC(=O)CCCc1ccccc1Cl Amb17236501 [1,1,0,0,0,0|0,0,0]=2 1412 B13R1.158 CC(=O)CCCc1ccccc1F Amb17233676 [1,1,0,0,0,0|0,0,0]=2 1413 B13R1.158 CC(=O)CCOc1ccccc1Cl Amb17139723 [1,1,0,0,0,0|1,0,0]=3 1414 B13R1.158 CC(=O)C\C=C\c1ccccc1Br Amb25155472 [1,1,0,0,0,0|0,0,2]=4 1415 B13R1.158 CC(=O)C\C=C\c1ccccc1Cl Amb25322439 [1,1,0,0,0,0|0,0,2]=4 1416 B13R1.158 CC(=O)C\C=C\c1ccccc1F Amb25693688 [1,1,0,0,0,0|0,0,2]=4 1417 B13R1.158 CC(=O)C\C=C\c1ccccc1O Amb25058690 [1,1,0,0,0,0|0,0,2]=4 1418 B13R1.158 CC(=O)C\C=N\c1ccccc1O Amb25373167 [1,1,0,0,0,0|1,0,1]=4 1419 B13R1.158 CC(=O)NCCc1[n]cccc1F Amb25668865 [1,1,0,0,0,0|2,0,0]=4 1420 B13R1.158 CC(=O)NCCc1ccccc1Br Amb13133608 [1,1,0,0,0,0|1,0,0]=3 1421 B13R1.158 CC(=O)NCCc1ccccc1C Amb15740396 [1,1,0,0,0,0|1,0,0]=3 1422 B13R1.158 CC(=O)NCCc1ccccc1Cl Amb25324158 [1,1,0,0,0,0|1,0,0]=3 1423 B13R1.158 CC(=O)NCCc1ccccc1O Amb16982301 [1,1,0,0,0,0|1,0,0]=3 1424 B13R1.158 CC(=O)NOCc1ccccc1F Amb24386771 [1,1,0,0,0,0|2,0,0]=4 1425 B13R1.158 CC(CCCc1ccccc1C)N Amb17233313 [1,1,0,0,0,0|1,0,1]=4 1426 B13R1.158 CC(CCCc1ccccc1Cl)N Amb17236681 [1,1,0,0,0,0|1,0,1]=4 1427 B13R1.158 CC(CCCc1ccccc1F)N Amb17233820 [1,1,0,0,0,0|1,0,1]=4 1428 B13R1.158 CN(CCCc1ccccc1N)C Amb17050681 [1,1,0,0,0,0|2,0,0]=4 1429 B13R1.158 CS(=O)CCNc1ccccc1Br Amb24538957 [1,1,0,0,0,0|2,0,0]=4 1430 B13R1.158 CS(=O)CCNc1ccccc1N Amb25774644 [1,1,0,0,0,0|2,0,0]=4 1431 B13R1.158 Cc1c[n]ccc1NCCC(O)=O Amb24455040 [1,1,0,0,0,0|2,0,0]=4 1432 B13R1.158 Cc1ccc[n]c1NCCC(O)=O Amb18604885 [1,1,0,0,0,0|2,0,0]=4 1433 B13R1.158 Cc1ccccc1C#CCC(O)=O Amb24659626 [1,1,0,0,0,0|0,0,2]=4 1434 B13R1.158 Cc1ccccc1CC#CC(O)=O Amb25736858 [1,1,0,0,0,0|0,0,2]=4 1435 B13R1.158 Cc1ccccc1CCNC(N)=O Amb25100964 [1,1,0,0,0,0|2,0,0]=4 1436 B13R1.158 Cc1ccccc1CONC(C)=O Amb25792311 [1,1,0,0,0,0|2,0,0]=4 1437 B13R1.158 Cc1ccccc1NCCC(C)=O Amb24664215 [1,1,0,0,0,0|1,0,0]=3 1438 B13R1.158 Cc1ccccc1\C=C/CC(C)=O Amb24492730 [1,1,0,0,0,0|0,0,2]=4 1439 B13R1.158 Cc1ccccc1\C=C\CC(O)=O Amb25362135 [1,1,0,0,0,0|0,0,2]=4 1440 B13R1.158 ClC(=C)CCCc1ccccc1C Amb13890663 [1,1,0,0,0,0|1,0,1]=4 1441 B13R1.158 ClC(=O)CCOc1ccccc1Cl Amb17143748 [1,1,0,0,0,0|2,0,0]=4 1442 B13R1.158 ClC(=O)CCSc1ccccc1Cl Amb17144559 [1,1,0,0,0,0|2,0,0]=4 1443 B13R1.158 NC(=N)CCCc1ccccc1Cl Amb10844870 [1,1,0,0,0,0|2,0,0]=4 1444 B13R1.158 NC(=O)CCCc1ccccc1Cl Amb22552422 [1,1,0,0,0,0|1,0,0]=3 1445 B13R1.158 NC(=O)CCNc1ccccc1N Amb2226251 [1,1,0,0,0,0|2,0,0]=4 1446 B13R1.158 NC(=O)CNCc1ccccc1O Amb1112462 [1,1,0,0,0,0|2,0,0]=4 1447 B13R1.158 NC(=O)NCCc1ccccc1Cl Amb24627934 [1,1,0,0,0,0|2,0,0]=4 1448 B13R1.158 Nc1ccccc1NCCC(N)=O Amb19514743 [1,1,0,0,0,0|2,0,0]=4 1449 B13R1.158 Nc1ccccc1NCCC(O)=O Amb18128679 [1,1,0,0,0,0|1,0,0]=3 1450 B13R1.158 Nc1ccccc1OCCC(O)=O Amb22728037 [1,1,0,0,0,0|1,0,0]=3 1451 B13R1.158 Nc1ncccc1OCCC(=O)O Amb17206788 [1,1,0,0,0,0|2,0,0]=4 1452 B13R1.158 O=C(Cl)CCCc1ccccc1Br Amb22295767 [1,1,0,0,0,0|1,0,0]=3 1453 B13R1.158 OC(=O)C#CCc1ccccc1Cl Amb25225009 [1,1,0,0,0,0|0,0,2]=4 1454 B13R1.158 OC(=O)CC#Cc1ccccc1Br Amb25775933 [1,1,0,0,0,0|0,0,2]=4 1455 B13R1.158 OC(=O)CC#Cc1ccccc1Cl Amb24686712 [1,1,0,0,0,0|0,0,2]=4 1456 B13R1.158 OC(=O)CC#Cc1ccccc1I Amb24492038 [1,1,0,0,0,0|0,0,2]=4 1457 B13R1.158 OC(=O)CC=Cc1ccccc1F Amb20622523 [1,1,0,0,0,0|0,0,2]=4 1458 B13R1.158 OC(=O)CCCN1C=CC=CC1=O Amb18028573 [1,1,0,0,0,0|1,0,0]=3 1459 B13R1.158 OC(=O)CCCN1N=CC=CC1=O Amb19036170 [1,1,0,0,0,0|2,0,0]=4 1460 B13R1.158 OC(=O)CCCc1ccccc1S Amb17616852 [1,1,0,0,0,0|0,0,0]=2 1461 B13R1.158 OC(=O)CCNc1[n]cccc1Br Amb24769761 [1,1,0,0,0,0|2,0,0]=4 1462 B13R1.158 OC(=O)CCNc1cc[n]cc1Br Amb24769757 [1,1,0,0,0,0|2,0,0]=4 1463 B13R1.158 OC(=O)CCNc1cc[n]cc1Cl Amb24769758 [1,1,0,0,0,0|2,0,0]=4 1464 B13R1.158 OC(=O)CCNc1ccc[n]c1Cl Amb18093072 [1,1,0,0,0,0|2,0,0]=4 1465 B13R1.158 OC(=O)CCNc1ccccc1Cl Amb2209165 [1,1,0,0,0,0|1,0,0]=3 1466 B13R1.158 OC(=O)CCNc1ccccc1F Amb2209161 [1,1,0,0,0,0|1,0,0]=3 1467 B13R1.158 OC(=O)CCNc1ncccc1Cl Amb1110143 [1,1,0,0,0,0|2,0,0]=4 1468 B13R1.158 OC(=O)CCOC1=CC=CNC1=O Amb18537464 [1,1,0,0,0,0|2,0,0]=4 1469 B13R1.158 OC(=O)CCOc1ccccc1Br Amb1117859 [1,1,0,0,0,0|1,0,0]=3 1470 B13R1.158 OC(=O)CCOc1ccccc1C Amb1102807 [1,1,0,0,0,0|1,0,0]=3 1471 B13R1.158 OC(=O)CCOc1ccccc1Cl Amb1112357 [1,1,0,0,0,0|1,0,0]=3 1472 B13R1.158 OC(=O)CCOc1ccccc1F Amb1102819 [1,1,0,0,0,0|1,0,0]=3 1473 B13R1.158 OC(=O)CCSc1ccccc1Br Amb1113939 [1,1,0,0,0,0|1,0,0]=3 1474 B13R1.158 OC(=O)CCSc1ccccc1Cl Amb1102789 [1,1,0,0,0,0|1,0,0]=3 1475 B13R1.158 OC(=O)CCSc1ccccc1N Amb17305640 [1,1,0,0,0,0|1,0,0]=3 1476 B13R1.158 OC(=O)CNCc1ccccc1Br Amb1111282 [1,1,0,0,0,0|1,0,0]=3 1477 B13R1.158 OC(=O)CNCc1ccccc1C Amb10609879 [1,1,0,0,0,0|1,0,0]=3 1478 B13R1.158 OC(=O)CNCc1ccccc1C Amb2372498 [1,1,0,0,0,0|1,0,0]=3 1479 B13R1.158 OC(=O)CNCc1ccccc1I Amb21861671 [1,1,0,0,0,0|1,0,0]=3 1480 B13R1.158 OC(=O)COCc1ccccc1C Amb17470623 [1,1,0,0,0,0|1,0,0]=3 1481 B13R1.158 OC(=O)COCc1ccccc1F Amb17470662 [1,1,0,0,0,0|1,0,0]=3 1482 B13R1.158 OC(=O)CSCc1ccccc1Br Amb2372136 [1,1,0,0,0,0|1,0,0]=3 1483 B13R1.158 OC(=O)CSCc1ccccc1C Amb1125979 [1,1,0,0,0,0|1,0,0]=3 1484 B13R1.158 OC(=O)CSCc1ccccc1Cl Amb1551137 [1,1,0,0,0,0|1,0,0]=3 1485 B13R1.158 OC(=O)CSCc1ccccc1I Amb24089653 [1,1,0,0,0,0|1,0,0]=3 1486 B13R1.158 OC(=O)C\C=C\c1ccccc1Cl Amb23441779 [1,1,0,0,0,0|0,0,2]=4 1487 B13R1.158 OC(=O)C\C=C\c1ccccc1F Amb22262956 [1,1,0,0,0,0|0,0,2]=4 1488 B13R1.158 OC(=O)OCCc1ccccc1Cl Amb24079959 [1,1,0,0,0,0|1,0,0]=3 1489 B13R1.158 Oc1ccccc1C#CCC(O)=O Amb25352437 [1,1,0,0,0,0|0,0,2]=4 1490 B13R1.158 Oc1ccccc1C\C=C\C(O)=O Amb24366638 [1,1,0,0,0,0|0,0,2]=4 1491 B13R1.158 Oc1ccccc1NCCC(O)=O Amb24650948 [1,1,0,0,0,0|1,0,0]=3 1492 B13R1.158 [O-][n+]1ccccc1NCCC(O)=O Amb25310295 [1,1,0,0,0,0|2,0,0]=4 1493 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [1,1,0,0,0,0|0,0,2]=4 1494 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [1,1,0,0,0,0|0,0,2]=4 1495 B13R1.348 CC(=O)CC(=O)Cc1cccc[n]1 Amb24076575 [1,1,0,0,0,0|1,0,1]=4 1496 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [1,1,0,0,0,0|1,0,1]=4 1497 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [1,1,0,0,0,0|1,0,1]=4 1498 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [1,1,0,0,0,0|1,0,0]=3 1499 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [1,1,0,0,0,0|1,0,1]=4 1500 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [1,1,0,0,0,0|1,0,1]=4 1501 B13R1.348 CC(=O)NC(C)Cc1c[n]ccc1 Amb25095297 [1,1,0,0,0,0|2,0,0]=4 1502 B13R1.348 CC(=O)NC(C)Cc1cc[n]cc1 Amb24705489 [1,1,0,0,0,0|2,0,0]=4 1503 B13R1.348 CC(=O)NC(N)Cc1ccccc1 Amb25322191 [1,1,0,0,0,0|1,0,0]=3 1504 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [1,1,0,0,0,0|1,0,0]=3 1505 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [1,1,0,0,0,0|1,0,0]=3 1506 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [1,1,0,0,0,0|0,0,2]=4 1507 B13R1.348 CC(C)CC(Br)Cc1ccccc1 Amb18049557 [1,1,0,0,0,0|1,0,1]=4 1508 B13R1.348 CC(C)CC(O)Cc1ccccc1 Amb18796054 [1,1,0,0,0,0|1,0,1]=4 1509 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [1,1,0,0,0,0|0,0,0]=2 1510 B13R1.348 CC(Cc1ccccn1)CC(=O)O Amb17335285 [1,1,0,0,0,0|1,0,0]=3 1511 B13R1.348 CC(Cc1cccnc1)CC(=O)O Amb17335287 [1,1,0,0,0,0|1,0,0]=3 1512 B13R1.348 CC(Cc1ccncc1)CC(=O)O Amb17335288 [1,1,0,0,0,0|1,0,0]=3 1513 B13R1.348 CC(Nc1ccccc1)CC(=O)N Amb17233441 [1,1,0,0,0,0|2,0,0]=4 1514 B13R1.348 CC(Oc1ccccc1)CC(=O)N Amb17233539 [1,1,0,0,0,0|2,0,0]=4 1515 B13R1.348 CN(Cc1cc[n]cc1)CC(O)=O Amb22586727 [1,1,0,0,0,0|2,0,0]=4 1516 B13R1.348 CN(Cc1ccc[n]c1)CC(O)=O Amb21955498 [1,1,0,0,0,0|2,0,0]=4 1517 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb21955225 [1,1,0,0,0,0|2,0,0]=4 1518 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb22586726 [1,1,0,0,0,0|2,0,0]=4 1519 B13R1.348 CN(Cc1ccccc1)CC(=O)Cl Amb17143178 [1,1,0,0,0,0|2,0,0]=4 1520 B13R1.348 CN(Cc1ccccc1)CC(=O)N Amb17142972 [1,1,0,0,0,0|2,0,0]=4 1521 B13R1.348 CN(Cc1ccccc1)CC(=O)O Amb10610460 [1,1,0,0,0,0|1,0,0]=3 1522 B13R1.348 C[C@@H](CC(N)=O)Nc1ccccc1 Amb24727147 [1,1,0,0,0,0|2,0,0]=4 1523 B13R1.348 C[C@H](CC(N)=O)Nc1ccccc1 Amb25707756 [1,1,0,0,0,0|2,0,0]=4 1524 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [1,1,0,0,0,0|2,0,0]=4 1525 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [1,1,0,0,0,0|0,0,2]=4 1526 B13R1.348 C\C(=C/c1ccccc1)\CC(=O)O Amb17594482 [1,1,0,0,0,0|0,0,2]=4 1527 B13R1.348 C\C(\CC(O)=O)=C\c1ccccc1 Amb25229524 [1,1,0,0,0,0|0,0,2]=4 1528 B13R1.348 NC(Cc1ccccc1)CC(O)=O Amb20623358 [1,1,0,0,0,0|0,0,0]=2 1529 B13R1.348 NC(Cc1ccccn1)CC(=O)O Amb17470627 [1,1,0,0,0,0|1,0,0]=3 1530 B13R1.348 NC(Cc1cccnc1)CC(=O)O Amb17470630 [1,1,0,0,0,0|1,0,0]=3 1531 B13R1.348 NC(Cc1ccncc1)CC(=O)O Amb17470634 [1,1,0,0,0,0|1,0,0]=3 1532 B13R1.348 N[C@@H](Cc1cc[n]cc1)CC(O)=O Amb22746344 [1,1,0,0,0,0|1,0,0]=3 1533 B13R1.348 N[C@@H](Cc1ccc[n]c1)CC(O)=O Amb22746342 [1,1,0,0,0,0|1,0,0]=3 1534 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [1,1,0,0,0,0|0,0,1]=3 1535 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [1,1,0,0,0,0|1,0,1]=4 1536 B13R1.348 O=C(Nc1ccccc1)CC(=O)O Amb2436726 [1,1,0,0,0,0|1,0,1]=4 1537 B13R1.348 O=C(Oc1ccccc1)CC(=O)O Amb2417322 [1,1,0,0,0,0|1,0,1]=4 1538 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [1,1,0,0,0,0|0,0,1]=3 1539 B13R1.348 OC(=O)CC(=S)Nc1ccccc1 Amb24470037 [1,1,0,0,0,0|1,0,1]=4 1540 B13R1.348 OC(=O)CC(Br)Cc1ccccc1 Amb18111137 [1,1,0,0,0,0|0,0,0]=2 1541 B13R1.348 OC(=O)CC(Cl)Cc1ccccc1 Amb18111136 [1,1,0,0,0,0|0,0,0]=2 1542 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [1,1,0,0,0,0|0,0,0]=2 1543 B13R1.348 [2H]C(Cc1ccccc1)C=C(C)C Amb22546630 [1,1,0,0,0,0|1,0,1]=4 1544 B13R1.351 C=C(CSc1ccccc1)C(O)=O Amb18130089 [1,1,0,0,0,0|1,0,1]=4 1545 B13R1.351 C=C(OCc1ccccc1)C(O)=O Amb24626599 [1,1,0,0,0,0|1,0,1]=4 1546 B13R1.351 CC(=C)C(C)CNc1ccccc1 Amb25192041 [1,1,0,0,0,0|2,0,0]=4 1547 B13R1.351 CC(=C)C(C)NCc1ccccc1 Amb25101597 [1,1,0,0,0,0|2,0,0]=4 1548 B13R1.351 CC(=O)C(=O)CNc1ccccc1 Amb25123358 [1,1,0,0,0,0|1,0,1]=4 1549 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [1,1,0,0,0,0|1,0,1]=4 1550 B13R1.351 CC(=O)C(C)C#Cc1ccccc1 Amb24492361 [1,1,0,0,0,0|0,0,2]=4 1551 B13R1.351 CC(=O)C(C)CNc1ccccc1 Amb25325974 [1,1,0,0,0,0|1,0,0]=3 1552 B13R1.351 CC(=O)C(C)NCc1ccccc1 Amb18127991 [1,1,0,0,0,0|1,0,0]=3 1553 B13R1.351 CC(=O)C(C)ONc1ccccc1 Amb24495021 [1,1,0,0,0,0|2,0,0]=4 1554 B13R1.351 CC(=O)C(C)\C=C/c1ccccc1 Amb25735093 [1,1,0,0,0,0|0,0,2]=4 1555 B13R1.351 CC(=O)C(C)\C=C\c1ccccc1 Amb24655091 [1,1,0,0,0,0|0,0,2]=4 1556 B13R1.351 CC(=O)C(Cl)ONc1ccccc1 Amb25858083 [1,1,0,0,0,0|2,0,0]=4 1557 B13R1.351 CC(=O)N(C)OCc1ccccc1 Amb25829924 [1,1,0,0,0,0|2,0,0]=4 1558 B13R1.351 CC(=O)[C@@H](C)\C=C\c1ccccc1 Amb24752492 [1,1,0,0,0,0|0,0,2]=4 1559 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [1,1,0,0,0,0|1,0,0]=3 1560 B13R1.351 CC(=O)[C@H](C)ONc1ccccc1 Amb24492768 [1,1,0,0,0,0|2,0,0]=4 1561 B13R1.351 CC(=O)[C@H](C)\C=C\c1ccccc1 Amb24602920 [1,1,0,0,0,0|0,0,2]=4 1562 B13R1.351 CC(C(=O)C)OCc1ccccc1 Amb16231123 [1,1,0,0,0,0|1,0,0]=3 1563 B13R1.351 CC(C(=O)N)COc1ccccc1 Amb17233540 [1,1,0,0,0,0|2,0,0]=4 1564 B13R1.351 CC(C(=O)O)CCc1ccncc1 Amb17335289 [1,1,0,0,0,0|1,0,0]=3 1565 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb10199880 [1,1,0,0,0,0|1,0,0]=3 1566 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb1111423 [1,1,0,0,0,0|1,0,0]=3 1567 B13R1.351 CC(C(=O)O)SCc1ccccc1 Amb1137630 [1,1,0,0,0,0|1,0,0]=3 1568 B13R1.351 CC(C)C(O)CCc1ccccc1 Amb18034016 [1,1,0,0,0,0|1,0,1]=4 1569 B13R1.351 CC(CNc1cc[n]cc1)C(O)=O Amb19027731 [1,1,0,0,0,0|2,0,0]=4 1570 B13R1.351 CC(OCc1ccccc1)C(=O)Cl Amb24354312 [1,1,0,0,0,0|2,0,0]=4 1571 B13R1.351 CC(\C=C\c1ccccc1)C(O)=O Amb18127714 [1,1,0,0,0,0|0,0,2]=4 1572 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)Cl Amb24533460 [1,1,0,0,0,0|2,0,0]=4 1573 B13R1.351 C[C@@H](OCc1ccccc1)C(N)=O Amb25192194 [1,1,0,0,0,0|2,0,0]=4 1574 B13R1.351 C[C@H](C(=O)O)NCc1ccccc1 Amb16185448 [1,1,0,0,0,0|1,0,0]=3 1575 B13R1.351 C[C@H](OCc1ccccc1)C(O)=O Amb25072743 [1,1,0,0,0,0|1,0,0]=3 1576 B13R1.351 C[C@H](\N=C\c1ccccc1)C(O)=O Amb25124071 [1,1,0,0,0,0|1,0,1]=4 1577 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [1,1,0,0,0,0|0,0,2]=4 1578 B13R1.351 C\C(=C/Cc1ccccc1)\C(O)=O Amb24462262 [1,1,0,0,0,0|0,0,2]=4 1579 B13R1.351 C\C(=N/Cc1ccccc1)\C(C)=O Amb25130600 [1,1,0,0,0,0|1,0,1]=4 1580 B13R1.351 N=C(NCc1ccccc1)C(O)=O Amb18128144 [1,1,0,0,0,0|1,0,1]=4 1581 B13R1.351 NC(=O)C(=O)CCc1ccccc1 Amb24273105 [1,1,0,0,0,0|1,0,1]=4 1582 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [1,1,0,0,0,0|1,0,0]=3 1583 B13R1.351 NC(=O)C(O)CNc1ccccc1 Amb24696346 [1,1,0,0,0,0|2,0,0]=4 1584 B13R1.351 NC(=O)C(O)COc1ccccc1 Amb22497384 [1,1,0,0,0,0|2,0,0]=4 1585 B13R1.351 NC(C(=O)O)CCc1ccncc1 Amb17470633 [1,1,0,0,0,0|1,0,0]=3 1586 B13R1.351 NC(CCc1cccc[n]1)C(O)=O Amb24117831 [1,1,0,0,0,0|1,0,0]=3 1587 B13R1.351 NC(CNc1ccccc1)C(O)=O Amb25360987 [1,1,0,0,0,0|1,0,0]=3 1588 B13R1.351 NC(CSc1ccccc1)C(O)=O Amb18325246 [1,1,0,0,0,0|1,0,0]=3 1589 B13R1.351 N[C@H](CCc1ccccc1)C(O)=O Amb17872441 [1,1,0,0,0,0|0,0,0]=2 1590 B13R1.351 N[C@H](CNc1ccccc1)C(O)=O Amb24652450 [1,1,0,0,0,0|1,0,0]=3 1591 B13R1.351 N[C@H](\C=C\c1ccccc1)C(O)=O Amb25187708 [1,1,0,0,0,0|0,0,2]=4 1592 B13R1.351 O=C(C(=O)C)NCc1ccccc1 Amb17400597 [1,1,0,0,0,0|1,0,1]=4 1593 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [1,1,0,0,0,0|1,0,1]=4 1594 B13R1.351 OC(=O)C(Br)CCc1ccccc1 Amb18662872 [1,1,0,0,0,0|0,0,0]=2 1595 B13R1.351 OC(=O)C(CCc1ccccn1)C Amb17335286 [1,1,0,0,0,0|1,0,0]=3 1596 B13R1.351 OC(=O)C(CCc1ccccn1)N Amb1101108 [1,1,0,0,0,0|1,0,0]=3 1597 B13R1.351 OC(=O)C(CCc1cccnc1)C Amb17233532 [1,1,0,0,0,0|1,0,0]=3 1598 B13R1.351 OC(=O)C(Cl)\N=N\c1ccccc1 Amb25724891 [1,1,0,0,0,0|2,0,0]=4 1599 B13R1.351 OC(=O)C(F)OCc1ccccc1 Amb25369072 [1,1,0,0,0,0|1,0,0]=3 1600 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb10609128 [1,1,0,0,0,0|2,0,0]=4 1601 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb1110995 [1,1,0,0,0,0|2,0,0]=4 1602 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb10199875 [1,1,0,0,0,0|2,0,0]=4 1603 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb1110808 [1,1,0,0,0,0|2,0,0]=4 1604 B13R1.351 OC(=O)C(O)C#Cc1ccccc1 Amb25111134 [1,1,0,0,0,0|0,0,2]=4 1605 B13R1.351 OC(=O)\C(\F)=C\Cc1ccccc1 Amb25265375 [1,1,0,0,0,0|0,0,2]=4 1606 B13R1.351 OC(C(=O)O)\C=C\c1ccccc1 Amb17594531 [1,1,0,0,0,0|0,0,2]=4 1607 B13R1.351 O[C@H](C(=O)O)CCc1ccccc1 Amb10603260 [1,1,0,0,0,0|0,0,0]=2 1608 B13R1.513 BrC(=C)CCCc1ccc(cc1)C Amb13890672 [1,1,0,0,0,0|1,0,1]=4 1609 B13R1.513 BrC(=C)CCCc1ccc(cc1)Cl Amb13890660 [1,1,0,0,0,0|1,0,1]=4 1610 B13R1.513 BrC(=C)CCCc1ccc(cc1)F Amb13890684 [1,1,0,0,0,0|1,0,1]=4 1611 B13R1.513 CC(=C)CCCc1ccc(cc1)C Amb13890673 [1,1,0,0,0,0|1,0,0]=3 1612 B13R1.513 CC(=C)CCCc1ccc(cc1)Cl Amb13890661 [1,1,0,0,0,0|1,0,0]=3 1613 B13R1.513 CC(=C)CCCc1ccc(cc1)F Amb13890685 [1,1,0,0,0,0|1,0,0]=3 1614 B13R1.513 CC(=C)CCNc1ccc(Br)cc1 Amb25803095 [1,1,0,0,0,0|2,0,0]=4 1615 B13R1.513 CC(=C)CCNc1ccc(F)cc1 Amb24533540 [1,1,0,0,0,0|2,0,0]=4 1616 B13R1.513 CC(=C)CCNc1ccc(I)cc1 Amb24386324 [1,1,0,0,0,0|2,0,0]=4 1617 B13R1.513 CC(=C)CNCc1ccc(Br)cc1 Amb24768740 [1,1,0,0,0,0|2,0,0]=4 1618 B13R1.513 CC(=C)CNCc1ccc(cc1)C Amb17308891 [1,1,0,0,0,0|2,0,0]=4 1619 B13R1.513 CC(=C)CNCc1ccc(cc1)Cl Amb17309084 [1,1,0,0,0,0|2,0,0]=4 1620 B13R1.513 CC(=C)CNCc1ccc(cc1)F Amb17308876 [1,1,0,0,0,0|2,0,0]=4 1621 B13R1.513 CC(=C)CSCc1ccc(cc1)N Amb17498611 [1,1,0,0,0,0|2,0,0]=4 1622 B13R1.513 CC(=N)NCCc1ccc(Cl)cc1 Amb25807067 [1,1,0,0,0,0|2,0,0]=4 1623 B13R1.513 CC(=O)CCCc1ccc(cc1)Br Amb17255478 [1,1,0,0,0,0|0,0,0]=2 1624 B13R1.513 CC(=O)CCCc1ccc(cc1)C Amb17233200 [1,1,0,0,0,0|0,0,0]=2 1625 B13R1.513 CC(=O)CCCc1ccc(cc1)Cl Amb17236503 [1,1,0,0,0,0|0,0,0]=2 1626 B13R1.513 CC(=O)CCCc1ccc(cc1)F Amb17233677 [1,1,0,0,0,0|0,0,0]=2 1627 B13R1.513 CC(=O)CCOc1ccc(cc1)Cl Amb17139725 [1,1,0,0,0,0|1,0,0]=3 1628 B13R1.513 CC(=O)CSCc1ccc(Cl)cc1 Amb24064340 [1,1,0,0,0,0|1,0,0]=3 1629 B13R1.513 CC(=O)C\C=C\c1ccc(Br)cc1 Amb24553090 [1,1,0,0,0,0|0,0,2]=4 1630 B13R1.513 CC(=O)C\C=C\c1ccc(Cl)cc1 Amb22490195 [1,1,0,0,0,0|0,0,2]=4 1631 B13R1.513 CC(=O)C\C=C\c1ccc(F)cc1 Amb25326496 [1,1,0,0,0,0|0,0,2]=4 1632 B13R1.513 CC(=O)C\C=C\c1ccc(O)cc1 Amb24747691 [1,1,0,0,0,0|0,0,2]=4 1633 B13R1.513 CC(=O)NCCC=1C=CC(=O)NC1 Amb25272227 [1,1,0,0,0,0|2,0,0]=4 1634 B13R1.513 CC(=O)NCCc1ccc(Br)c[n]1 Amb24436674 [1,1,0,0,0,0|2,0,0]=4 1635 B13R1.513 CC(=O)NCCc1ccc(Br)cc1 Amb24451176 [1,1,0,0,0,0|1,0,0]=3 1636 B13R1.513 CC(=O)NCCc1ccc(Cl)[n]c1 Amb24683764 [1,1,0,0,0,0|2,0,0]=4 1637 B13R1.513 CC(=O)NCCc1ccc(Cl)cc1 Amb22227659 [1,1,0,0,0,0|1,0,0]=3 1638 B13R1.513 CC(=O)NCCc1ccc(cc1)N Amb17138877 [1,1,0,0,0,0|1,0,0]=3 1639 B13R1.513 CC(=O)NCOc1ccc(N)cc1 Amb24072944 [1,1,0,0,0,0|2,0,0]=4 1640 B13R1.513 CC(=O)NOCc1ccc(Br)cc1 Amb24584005 [1,1,0,0,0,0|2,0,0]=4 1641 B13R1.513 CC(=O)NOCc1ccc(Cl)cc1 Amb25099136 [1,1,0,0,0,0|2,0,0]=4 1642 B13R1.513 CC(=O)NOCc1ccc(F)cc1 Amb24704201 [1,1,0,0,0,0|2,0,0]=4 1643 B13R1.513 CC(=O)OCCc1ccc(cc1)O Amb17607347 [1,1,0,0,0,0|1,0,0]=3 1644 B13R1.513 CC(CCCc1ccc(cc1)Br)N Amb17255967 [1,1,0,0,0,0|1,0,1]=4 1645 B13R1.513 CC(CCCc1ccc(cc1)C)N Amb17233315 [1,1,0,0,0,0|1,0,1]=4 1646 B13R1.513 CC(CCCc1ccc(cc1)Cl)N Amb17236683 [1,1,0,0,0,0|1,0,1]=4 1647 B13R1.513 CC(CCCc1ccc(cc1)F)N Amb17233821 [1,1,0,0,0,0|1,0,1]=4 1648 B13R1.513 CN(C)CCCc1ccc(O)cc1 Amb20671018 [1,1,0,0,0,0|2,0,0]=4 1649 B13R1.513 CS(=O)CCNc1ccc(Br)cc1 Amb25229260 [1,1,0,0,0,0|2,0,0]=4 1650 B13R1.513 CS(=O)CCNc1ccc(Cl)cc1 Amb25265284 [1,1,0,0,0,0|2,0,0]=4 1651 B13R1.513 Cc1ccc(CC#CC(O)=O)cc1 Amb24438863 [1,1,0,0,0,0|0,0,2]=4 1652 B13R1.513 Cc1ccc(CCCC(N)=S)cc1 Amb18626184 [1,1,0,0,0,0|1,1,0]=4 1653 B13R1.513 Cc1ccc(CCCC(O)=O)[n][n]1 Amb18193835 [1,1,0,0,0,0|2,0,0]=4 1654 B13R1.513 Cc1ccc(CCOC(C)=O)cc1 Amb24100708 [1,1,0,0,0,0|1,0,0]=3 1655 B13R1.513 Cc1ccc(C\C=C\C(C)=O)cc1 Amb25179399 [1,1,0,0,0,0|0,0,2]=4 1656 B13R1.513 Cc1ccc(\C=C/CC(C)=O)cc1 Amb24492797 [1,1,0,0,0,0|0,0,2]=4 1657 B13R1.513 Cc1ccc(\C=C\CC(C)=O)cc1 Amb24447420 [1,1,0,0,0,0|0,0,2]=4 1658 B13R1.513 Cc1ccc(cc1)NCCC(C)=O Amb25155561 [1,1,0,0,0,0|1,0,0]=3 1659 B13R1.513 Cc1ccc(cc1)[Te]CCC(O)=O Amb22367959 [1,1,0,0,0,0|1,0,0]=3 1660 B13R1.513 ClC(=C)CCCc1ccc(cc1)C Amb13890671 [1,1,0,0,0,0|1,0,1]=4 1661 B13R1.513 ClC(=C)CCCc1ccc(cc1)Cl Amb13890659 [1,1,0,0,0,0|1,0,1]=4 1662 B13R1.513 ClC(=C)CCCc1ccc(cc1)F Amb13890683 [1,1,0,0,0,0|1,0,1]=4 1663 B13R1.513 ClC(=O)CCOc1ccc(cc1)C Amb17143210 [1,1,0,0,0,0|2,0,0]=4 1664 B13R1.513 ClC(=O)CCOc1ccc(cc1)Cl Amb17143749 [1,1,0,0,0,0|2,0,0]=4 1665 B13R1.513 ClC(=O)CCSc1ccc(cc1)Cl Amb17144561 [1,1,0,0,0,0|2,0,0]=4 1666 B13R1.513 NC(=O)CCCc1ccc(cc1)C Amb17233276 [1,1,0,0,0,0|1,0,0]=3 1667 B13R1.513 NC(=O)CCCc1ccc(cc1)Cl Amb17236667 [1,1,0,0,0,0|1,0,0]=3 1668 B13R1.513 NC(=O)CCCc1ccc(cc1)F Amb17233787 [1,1,0,0,0,0|1,0,0]=3 1669 B13R1.513 NC(=O)CCNc1ccc(cc1)F Amb1670561 [1,1,0,0,0,0|2,0,0]=4 1670 B13R1.513 NC(=O)CCSc1ccc(cc1)Br Amb15962728 [1,1,0,0,0,0|2,0,0]=4 1671 B13R1.513 NC(=O)CCSc1ccc(cc1)Cl Amb1539927 [1,1,0,0,0,0|2,0,0]=4 1672 B13R1.513 NC(=O)CNCc1ccc(cc1)Br Amb1120953 [1,1,0,0,0,0|2,0,0]=4 1673 B13R1.513 NC(=O)CNCc1ccc(cc1)C Amb1112534 [1,1,0,0,0,0|2,0,0]=4 1674 B13R1.513 NC(=O)CNCc1ccc(cc1)Cl Amb1112155 [1,1,0,0,0,0|2,0,0]=4 1675 B13R1.513 NC(=O)CNCc1ccc(cc1)F Amb1118480 [1,1,0,0,0,0|2,0,0]=4 1676 B13R1.513 NC(=O)CSCc1ccc(cc1)Cl Amb1179222 [1,1,0,0,0,0|2,0,0]=4 1677 B13R1.513 NC(=O)CSCc1ccc(cc1)N Amb17497163 [1,1,0,0,0,0|2,0,0]=4 1678 B13R1.513 NC(=O)NCCc1ccc(O)cc1 Amb18181065 [1,1,0,0,0,0|2,0,0]=4 1679 B13R1.513 NC(=O)NCCc1ccc(cc1)Cl Amb12806713 [1,1,0,0,0,0|2,0,0]=4 1680 B13R1.513 NC(=S)CCCc1ccc(Cl)cc1 Amb18107322 [1,1,0,0,0,0|1,1,0]=4 1681 B13R1.513 Nc1ccc(CCCC(O)=O)[n][n]1 Amb18193191 [1,1,0,0,0,0|2,0,0]=4 1682 B13R1.513 Nc1ccc(CCNC(N)=O)cc1 Amb18973442 [1,1,0,0,0,0|2,0,0]=4 1683 B13R1.513 Nc1ccc(cc1)C#CCC(O)=O Amb25341249 [1,1,0,0,0,0|0,0,2]=4 1684 B13R1.513 Nc1ccc(cc1)NCCC(N)=O Amb19373175 [1,1,0,0,0,0|2,0,0]=4 1685 B13R1.513 Nc1ccc(cc1)NCCC(O)=O Amb25060675 [1,1,0,0,0,0|1,0,0]=3 1686 B13R1.513 Nc1ccc(cc1)OCCC(O)=O Amb19348346 [1,1,0,0,0,0|1,0,0]=3 1687 B13R1.513 Nc1ccc(cc1)SCCC(O)=O Amb19014210 [1,1,0,0,0,0|1,0,0]=3 1688 B13R1.513 O=C(Cl)CCSc1ccc(F)cc1 Amb22642142 [1,1,0,0,0,0|2,0,0]=4 1689 B13R1.513 OC(=O)CC#Cc1ccc(I)cc1 Amb25783158 [1,1,0,0,0,0|0,0,2]=4 1690 B13R1.513 OC(=O)CCCN1C=CC(=O)C=C1 Amb18029469 [1,1,0,0,0,0|1,0,0]=3 1691 B13R1.513 OC(=O)CCCc1ccc(Br)[n][n]1 Amb18155629 [1,1,0,0,0,0|2,0,0]=4 1692 B13R1.513 OC(=O)CCCc1ccc(Cl)[n][n]1 Amb18187269 [1,1,0,0,0,0|2,0,0]=4 1693 B13R1.513 OC(=O)CCCc1ccc(cc1)C Amb2568475 [1,1,0,0,0,0|0,0,0]=2 1694 B13R1.513 OC(=O)CCCc1ccc(cc1)O Amb10602364 [1,1,0,0,0,0|0,0,0]=2 1695 B13R1.513 OC(=O)CCCc1ccc(cc1)S Amb17616854 [1,1,0,0,0,0|0,0,0]=2 1696 B13R1.513 OC(=O)CCNc1ccc(cc1)Br Amb2209168 [1,1,0,0,0,0|1,0,0]=3 1697 B13R1.513 OC(=O)CCNc1ccc(cc1)C Amb2209164 [1,1,0,0,0,0|1,0,0]=3 1698 B13R1.513 OC(=O)CCNc1ccc(cc1)Cl Amb2209167 [1,1,0,0,0,0|1,0,0]=3 1699 B13R1.513 OC(=O)CCNc1ccc(cc1)F Amb2209163 [1,1,0,0,0,0|1,0,0]=3 1700 B13R1.513 OC(=O)CCOc1ccc(cc1)Br Amb1118334 [1,1,0,0,0,0|1,0,0]=3 1701 B13R1.513 OC(=O)CCOc1ccc(cc1)Cl Amb1115231 [1,1,0,0,0,0|1,0,0]=3 1702 B13R1.513 OC(=O)CCOc1ccc(cc1)F Amb1119259 [1,1,0,0,0,0|1,0,0]=3 1703 B13R1.513 OC(=O)CCSc1ccc(cc1)Br Amb1118833 [1,1,0,0,0,0|1,0,0]=3 1704 B13R1.513 OC(=O)CCSc1ccc(cc1)C Amb1102788 [1,1,0,0,0,0|1,0,0]=3 1705 B13R1.513 OC(=O)CCSc1ccc(cc1)Cl Amb1102804 [1,1,0,0,0,0|1,0,0]=3 1706 B13R1.513 OC(=O)CCSc1ccc(cc1)F Amb1215312 [1,1,0,0,0,0|1,0,0]=3 1707 B13R1.513 OC(=O)CC[Te]c1ccc(Br)cc1 Amb22359444 [1,1,0,0,0,0|1,0,0]=3 1708 B13R1.513 OC(=O)CNCc1ccc(Br)[n]c1 Amb21861851 [1,1,0,0,0,0|2,0,0]=4 1709 B13R1.513 OC(=O)CNCc1ccc(cc1)Cl Amb1111327 [1,1,0,0,0,0|1,0,0]=3 1710 B13R1.513 OC(=O)CNCc1ccc(cc1)Cl Amb15740982 [1,1,0,0,0,0|1,0,0]=3 1711 B13R1.513 OC(=O)CNCc1ccc(cc1)F Amb10610178 [1,1,0,0,0,0|1,0,0]=3 1712 B13R1.513 OC(=O)CNCc1ccc(cc1)F Amb2372201 [1,1,0,0,0,0|1,0,0]=3 1713 B13R1.513 OC(=O)CNCc1ccc(nc1)Cl Amb10597607 [1,1,0,0,0,0|2,0,0]=4 1714 B13R1.513 OC(=O)COCc1ccc(cc1)C Amb17470625 [1,1,0,0,0,0|1,0,0]=3 1715 B13R1.513 OC(=O)COCc1ccc(cc1)Cl Amb17471000 [1,1,0,0,0,0|1,0,0]=3 1716 B13R1.513 OC(=O)COCc1ccc(cc1)F Amb17470663 [1,1,0,0,0,0|1,0,0]=3 1717 B13R1.513 OC(=O)CON=C1C=CC(=O)C=C1 Amb24496821 [1,1,0,0,0,0|2,0,0]=4 1718 B13R1.513 OC(=O)CSCc1ccc(cc1)C Amb1211907 [1,1,0,0,0,0|1,0,0]=3 1719 B13R1.513 OC(=O)CSCc1ccc(cc1)F Amb1210139 [1,1,0,0,0,0|1,0,0]=3 1720 B13R1.513 OC(=O)CSCc1ccc(cc1)N Amb17497517 [1,1,0,0,0,0|1,0,0]=3 1721 B13R1.513 OC(=O)C\C=C\c1ccc(Br)cc1 Amb18577486 [1,1,0,0,0,0|0,0,2]=4 1722 B13R1.513 OC(=O)C\C=C\c1ccc(Cl)cc1 Amb18066407 [1,1,0,0,0,0|0,0,2]=4 1723 B13R1.513 OC(=O)C\C=C\c1ccc(F)cc1 Amb18065898 [1,1,0,0,0,0|0,0,2]=4 1724 B13R1.513 OC(=O)\C=C\Cc1ccc(F)cc1 Amb25697178 [1,1,0,0,0,0|0,0,2]=4 1725 B13R1.513 Oc1ccc(CCCC(=O)Cl)cc1 Amb20621445 [1,1,0,0,0,0|1,0,0]=3 1726 B13R1.513 Oc1ccc(\C=C\CC(O)=O)cc1 Amb18128099 [1,1,0,0,0,0|0,0,2]=4 1727 B13R1.513 Oc1ccc(\C=N\CC(O)=O)cc1 Amb24621335 [1,1,0,0,0,0|1,0,1]=4 1728 B13R1.513 Oc1ccc(cc1)C#CCC(O)=O Amb24683847 [1,1,0,0,0,0|0,0,2]=4 1729 B13R1.3523 CC(CCCc1ccccc1)(N)C Amb17400637 [1,1,0,0,0,0|1,0,1]=4 1730 B13R1.3523 CC(CCCc1ccccc1)(O)C Amb17400670 [1,1,0,0,0,0|0,0,2]=4 1731 B13R1.3523 CP(C)(=O)CNCc1ccccc1 Amb25804602 [1,1,0,0,0,0|2,0,0]=4 1732 B13R1.3523 CS(=O)(=O)CCNc1ccccc1 Amb19004864 [1,1,0,0,0,0|2,0,0]=4 1733 B13R1.3523 CS(=O)(=O)OCCc1ccccc1 Amb22493888 [1,1,0,0,0,0|2,0,0]=4 1734 B13R1.3523 C[Si](C)(Cl)CCCc1ccccc1 Amb19893686 [1,1,0,0,0,0|1,1,0]=4 1735 B13R1.3523 NS(=O)(=O)CCCc1ccccc1 Amb18322199 [1,1,0,0,0,0|1,0,1]=4 1736 B13R1.3523 OP(O)(=O)CCCc1ccccc1 Amb22471211 [1,1,0,0,0,0|1,0,0]=3 1737 B13R1.3523 OP(O)(=O)CNCc1ccccc1 Amb24490389 [1,1,0,0,0,0|2,0,0]=4 1738 B13R1.3523 OS(=O)(=O)CNCc1ccccc1 Amb22464481 [1,1,0,0,0,0|2,0,0]=4 1739 B13R1.3523 OS(=O)(=O)NCCc1ccccc1 Amb22051654 [1,1,0,0,0,0|2,0,0]=4 1740 B13R1.11 CC(CC(=O)C#N)c1ccccc1 Amb24494969 [0,1,0,0,1,0|2,0,0]=4 1741 B13R1.11 CC(CC(=O)NO)c1ccccc1 Amb24387362 [0,1,0,0,1,0|2,0,0]=4 1742 B13R1.11 CCC(=O)CC(c1ccccc1)C Amb17594493 [0,1,0,0,1,0|1,0,0]=3 1743 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,1,0,0,1,0|2,0,0]=4 1744 B13R1.11 CN(CC(=O)NC)c1ccccc1 Amb19971421 [0,1,0,0,1,0|2,0,0]=4 1745 B13R1.11 CN(CC(=O)OC)c1cccc[n]1 Amb18186549 [0,1,0,0,1,0|2,0,0]=4 1746 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,1,0,0,1,0|1,0,1]=4 1747 B13R1.11 CNC(=O)CC(=S)c1ccccc1 Amb25125271 [0,1,0,0,1,0|1,0,1]=4 1748 B13R1.11 CNC(=O)CC(C)c1cc[n]cc1 Amb25686680 [0,1,0,0,1,0|2,0,0]=4 1749 B13R1.11 CNC(=O)CC(C)c1ccc[n]c1 Amb24397679 [0,1,0,0,1,0|2,0,0]=4 1750 B13R1.11 CNC(=O)CC(c1cccnc1)N Amb17233543 [0,1,0,0,1,0|2,0,0]=4 1751 B13R1.11 CNC(=O)CS(=O)c1ccccc1 Amb25807172 [0,1,0,0,1,0|2,0,0]=4 1752 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,1,0,0,1,0|1,0,0]=3 1753 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,1,0,0,1,0|1,0,0]=3 1754 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,1,0,0,1,0|1,0,0]=3 1755 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,1,0,0,1,0|1,0,0]=3 1756 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,1,0,0,1,0|2,0,0]=4 1757 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,1,0,0,1,0|2,0,0]=4 1758 B13R1.11 COC(=N)CC(=O)c1ccccc1 Amb22433441 [0,1,0,0,1,0|1,0,1]=4 1759 B13R1.11 COC(=O)CC(=O)c1cccc[n]1 Amb21857821 [0,1,0,0,1,0|1,0,1]=4 1760 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,1,0,0,1,0|0,0,1]=3 1761 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,1,0,0,1,0|0,0,0]=2 1762 B13R1.11 COC(=O)CC(O)c1c[n]cc[n]1 Amb22296209 [0,1,0,0,1,0|2,0,0]=4 1763 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,1,0,0,1,0|0,0,0]=2 1764 B13R1.11 COC(=O)CC(c1ccccc1)N Amb1221582 [0,1,0,0,1,0|0,0,0]=2 1765 B13R1.11 COC(=O)CC(c1ccccc1)N Amb2371447 [0,1,0,0,1,0|0,0,0]=2 1766 B13R1.11 COC(=O)C[C@@H](C)c1ccccc1 Amb22363030 [0,1,0,0,1,0|0,0,0]=2 1767 B13R1.11 COC(=O)C[C@@H](N)c1ccc[n]c1 Amb24107581 [0,1,0,0,1,0|1,0,0]=3 1768 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,0,0,1,0|0,0,0]=2 1769 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,0,0,1,0|0,0,0]=2 1770 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N Amb17617178 [0,1,0,0,1,0|0,0,0]=2 1771 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,0,0,1,0|0,0,0]=2 1772 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,1,0,0,1,0|1,0,1]=4 1773 B13R1.11 COC(=O)NC(=O)c1ccccc1 Amb25190157 [0,1,0,0,1,0|1,0,1]=4 1774 B13R1.11 COC(=O)NC(C)c1ccc[n]c1 Amb25155951 [0,1,0,0,1,0|2,0,0]=4 1775 B13R1.11 COC(=O)NC(c1ccccc1)C Amb10568146 [0,1,0,0,1,0|1,0,0]=3 1776 B13R1.11 COC(=O)N[C@@H](C)c1cccc[n]1 Amb25788838 [0,1,0,0,1,0|2,0,0]=4 1777 B13R1.11 COC(=O)N[C@@H](C)c1ccccc1 Amb24611219 [0,1,0,0,1,0|1,0,0]=3 1778 B13R1.11 COC(=O)N[C@H](C)c1ccc[n]c1 Amb25821184 [0,1,0,0,1,0|2,0,0]=4 1779 B13R1.11 COC(=O)N[C@H](C)c1cccc[n]1 Amb24466639 [0,1,0,0,1,0|2,0,0]=4 1780 B13R1.11 COC(=O)N[C@H](C)c1ccccc1 Amb24666677 [0,1,0,0,1,0|1,0,0]=3 1781 B13R1.11 COC(=O)\C=C(\N)/c1ccccc1 Amb25258009 [0,1,0,0,1,0|0,0,2]=4 1782 B13R1.11 CSC(=O)NC(C)c1ccccc1 Amb25292316 [0,1,0,0,1,0|1,1,0]=4 1783 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,1,0,0,1,0|2,0,0]=4 1784 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,1,0,0,1,0|2,0,0]=4 1785 B13R1.11 NC(CC(=O)NO)c1ccccc1 Amb25118570 [0,1,0,0,1,0|2,0,0]=4 1786 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,1,0,0,1,0|2,0,0]=4 1787 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,1,0,0,1,0|2,0,0]=4 1788 B13R1.11 N[C@H](CC(=O)NO)c1ccccc1 Amb24586364 [0,1,0,0,1,0|2,0,0]=4 1789 B13R1.14 CCC(=O)CCc1ccc(O)cc1 Amb22547635 [0,1,0,0,1,0|1,0,0]=3 1790 B13R1.14 CCC(=O)COc1ccc(N)cc1 Amb22010451 [0,1,0,0,1,0|2,0,0]=4 1791 B13R1.14 CCC(=O)CSc1ccc(Cl)cc1 Amb19415865 [0,1,0,0,1,0|2,0,0]=4 1792 B13R1.14 CCC(=O)NCc1ccc(F)cc1 Amb17790296 [0,1,0,0,1,0|2,0,0]=4 1793 B13R1.14 CCC(=O)NCc1ccc(O)cc1 Amb18648248 [0,1,0,0,1,0|2,0,0]=4 1794 B13R1.14 CCC(=O)NCc1ccc(cc1)N Amb17138876 [0,1,0,0,1,0|2,0,0]=4 1795 B13R1.14 CNC(=O)CCc1ccc(Br)cc1 Amb22900135 [0,1,0,0,1,0|1,0,0]=3 1796 B13R1.14 CNC(=O)CCc1ccc(Cl)cc1 Amb23223308 [0,1,0,0,1,0|1,0,0]=3 1797 B13R1.14 CNC(=O)CCc1ccc(cc1)C Amb15744093 [0,1,0,0,1,0|1,0,0]=3 1798 B13R1.14 CNC(=O)COc1ccc(cc1)C Amb2040393 [0,1,0,0,1,0|2,0,0]=4 1799 B13R1.14 CNC(=O)COc1ccc(cc1)I Amb15778875 [0,1,0,0,1,0|2,0,0]=4 1800 B13R1.14 CNC(=O)CSc1ccc(O)cc1 Amb18321658 [0,1,0,0,1,0|2,0,0]=4 1801 B13R1.14 CNC(=O)NCc1ccc(O)cc1 Amb24491496 [0,1,0,0,1,0|2,0,0]=4 1802 B13R1.14 CNC(=O)NCc1ccc(cc1)Cl Amb2132765 [0,1,0,0,1,0|2,0,0]=4 1803 B13R1.14 CNC(=O)NCc1ccc(cc1)F Amb2132767 [0,1,0,0,1,0|2,0,0]=4 1804 B13R1.14 CNC(=O)OCc1ccc(Cl)cc1 Amb22469905 [0,1,0,0,1,0|2,0,0]=4 1805 B13R1.14 CNC(=O)OCc1ccc(F)cc1 Amb24653697 [0,1,0,0,1,0|2,0,0]=4 1806 B13R1.14 CNC(=O)OCc1ccc(N)cc1 Amb25273466 [0,1,0,0,1,0|2,0,0]=4 1807 B13R1.14 CNC(=O)SCc1ccc(Cl)cc1 Amb24490438 [0,1,0,0,1,0|2,0,0]=4 1808 B13R1.14 COC(=N)CCc1ccc(Br)cc1 Amb18071193 [0,1,0,0,1,0|1,0,0]=3 1809 B13R1.14 COC(=N)CCc1ccc(Cl)cc1 Amb18066448 [0,1,0,0,1,0|1,0,0]=3 1810 B13R1.14 COC(=N)CCc1ccc(F)cc1 Amb18066004 [0,1,0,0,1,0|1,0,0]=3 1811 B13R1.14 COC(=N)COc1ccc(Br)cc1 Amb18071477 [0,1,0,0,1,0|2,0,0]=4 1812 B13R1.14 COC(=N)COc1ccc(Cl)cc1 Amb18066509 [0,1,0,0,1,0|2,0,0]=4 1813 B13R1.14 COC(=N)COc1ccc(F)cc1 Amb18066094 [0,1,0,0,1,0|2,0,0]=4 1814 B13R1.14 COC(=O)/C=C/c1ccc(C)cc1 Amb17844465 [0,1,0,0,1,0|0,0,2]=4 1815 B13R1.14 COC(=O)C#Cc1ccc(F)cc1 Amb25726510 [0,1,0,0,1,0|0,0,2]=4 1816 B13R1.14 COC(=O)C#Cc1ccc(N)cc1 Amb25257395 [0,1,0,0,1,0|0,0,2]=4 1817 B13R1.14 COC(=O)C#Cc1ccc(O)cc1 Amb25262685 [0,1,0,0,1,0|0,0,2]=4 1818 B13R1.14 COC(=O)C=Cc1ccc(N)cc1 Amb24079687 [0,1,0,0,1,0|0,0,2]=4 1819 B13R1.14 COC(=O)C=Cc1ccc(cc1)Br Amb13883656 [0,1,0,0,1,0|0,0,2]=4 1820 B13R1.14 COC(=O)CCc1ccc(N)[n]c1 Amb24183802 [0,1,0,0,1,0|1,0,0]=3 1821 B13R1.14 COC(=O)CCc1ccc(cc1)Br Amb15692693 [0,1,0,0,1,0|0,0,0]=2 1822 B13R1.14 COC(=O)CCc1ccc(cc1)C Amb17400662 [0,1,0,0,1,0|0,0,0]=2 1823 B13R1.14 COC(=O)CCc1ccc(cc1)Cl Amb1093990 [0,1,0,0,1,0|0,0,0]=2 1824 B13R1.14 COC(=O)CCc1ccc(cc1)F Amb17400909 [0,1,0,0,1,0|0,0,0]=2 1825 B13R1.14 COC(=O)CNc1ccc(F)c[n]1 Amb19045363 [0,1,0,0,1,0|2,0,0]=4 1826 B13R1.14 COC(=O)CNc1ccc(cc1)Br Amb1921801 [0,1,0,0,1,0|1,0,0]=3 1827 B13R1.14 COC(=O)CNc1ccc(cc1)O Amb10604010 [0,1,0,0,1,0|1,0,0]=3 1828 B13R1.14 COC(=O)CNc1ccc(cc1)O Amb10604138 [0,1,0,0,1,0|1,0,0]=3 1829 B13R1.14 COC(=O)CNc1ccc(cn1)N Amb1120232 [0,1,0,0,1,0|2,0,0]=4 1830 B13R1.14 COC(=O)COc1ccc(N)cc1 Amb23385314 [0,1,0,0,1,0|1,0,0]=3 1831 B13R1.14 COC(=O)COc1ccc(O)c[n]1 Amb24095899 [0,1,0,0,1,0|2,0,0]=4 1832 B13R1.14 COC(=O)COc1ccc(cc1)I Amb1929651 [0,1,0,0,1,0|1,0,0]=3 1833 B13R1.14 COC(=O)COc1ccc(cc1)O Amb10975204 [0,1,0,0,1,0|1,0,0]=3 1834 B13R1.14 COC(=O)CSc1ccc(N)cc1 Amb24066581 [0,1,0,0,1,0|1,0,0]=3 1835 B13R1.14 COC(=O)CSc1ccc(O)cc1 Amb18321905 [0,1,0,0,1,0|1,0,0]=3 1836 B13R1.14 COC(=O)NCC1=CNC(=O)C=C1 Amb25232375 [0,1,0,0,1,0|2,0,0]=4 1837 B13R1.14 COC(=O)NCc1ccc(Br)cc1 Amb25101223 [0,1,0,0,1,0|1,0,0]=3 1838 B13R1.14 COC(=O)NCc1ccc(C)cc1 Amb17869525 [0,1,0,0,1,0|1,0,0]=3 1839 B13R1.14 COC(=O)NCc1ccc(Cl)c[n]1 Amb25741010 [0,1,0,0,1,0|2,0,0]=4 1840 B13R1.14 COC(=O)NCc1ccc(F)cc1 Amb17860018 [0,1,0,0,1,0|1,0,0]=3 1841 B13R1.14 COC(=O)NCc1ccc(O)cc1 Amb24423720 [0,1,0,0,1,0|1,0,0]=3 1842 B13R1.14 COC(=O)NN=C1C=CC(=O)C=C1 Amb24594193 [0,1,0,0,1,0|2,0,0]=4 1843 B13R1.14 COC(=O)NNc1ccc(F)cc1 Amb24370510 [0,1,0,0,1,0|2,0,0]=4 1844 B13R1.14 COC(=O)\C=C/c1ccc(Br)cc1 Amb24668018 [0,1,0,0,1,0|0,0,2]=4 1845 B13R1.14 COC(=O)\C=C/c1ccc(O)cc1 Amb23469768 [0,1,0,0,1,0|0,0,2]=4 1846 B13R1.14 COC(=O)\C=C\c1ccc(Br)cc1 Amb19894690 [0,1,0,0,1,0|0,0,2]=4 1847 B13R1.14 COC(=O)\C=C\c1ccc(I)cc1 Amb25726381 [0,1,0,0,1,0|0,0,2]=4 1848 B13R1.14 COC(=O)\C=C\c1ccc(cc1)S Amb17616841 [0,1,0,0,1,0|0,0,2]=4 1849 B13R1.14 Cc1ccc(CCC(=N)OC)cc1 Amb18065699 [0,1,0,0,1,0|1,0,0]=3 1850 B13R1.14 Cc1ccc(CCC(=O)CN)cc1 Amb18065723 [0,1,0,0,1,0|2,0,0]=4 1851 B13R1.14 Cc1ccc(CCC(=O)CO)cc1 Amb18065754 [0,1,0,0,1,0|2,0,0]=4 1852 B13R1.14 Cc1ccc(CCC(=O)NO)cc1 Amb18186323 [0,1,0,0,1,0|2,0,0]=4 1853 B13R1.14 Cc1ccc(CCC(=O)OC)c[n]1 Amb24066591 [0,1,0,0,1,0|1,0,0]=3 1854 B13R1.14 Cc1ccc(CNC(=O)OC)c[n]1 Amb25190127 [0,1,0,0,1,0|2,0,0]=4 1855 B13R1.14 Cc1ccc(CNC(=O)SC)cc1 Amb24563855 [0,1,0,0,1,0|1,1,0]=4 1856 B13R1.14 Cc1ccc(\C=N\C(=O)OC)cc1 Amb24095905 [0,1,0,0,1,0|1,0,1]=4 1857 B13R1.14 Cc1ccc(cc1)OCC(=N)OC Amb18065839 [0,1,0,0,1,0|2,0,0]=4 1858 B13R1.14 ClCC(=O)CCc1ccc(cc1)Br Amb17163906 [0,1,0,0,1,0|2,0,0]=4 1859 B13R1.14 ClCC(=O)CCc1ccc(cc1)C Amb17139634 [0,1,0,0,1,0|2,0,0]=4 1860 B13R1.14 ClCC(=O)CCc1ccc(cc1)Cl Amb17141006 [0,1,0,0,1,0|2,0,0]=4 1861 B13R1.14 ClCC(=O)CCc1ccc(cc1)F Amb17139827 [0,1,0,0,1,0|2,0,0]=4 1862 B13R1.14 NCC(=O)CCc1ccc(Br)cc1 Amb18156196 [0,1,0,0,1,0|2,0,0]=4 1863 B13R1.14 NCC(=O)CCc1ccc(Cl)cc1 Amb18565992 [0,1,0,0,1,0|2,0,0]=4 1864 B13R1.14 NCC(=O)CCc1ccc(F)cc1 Amb18066019 [0,1,0,0,1,0|2,0,0]=4 1865 B13R1.14 NNC(=O)CCc1ccc(Cl)cc1 Amb22461103 [0,1,0,0,1,0|2,0,0]=4 1866 B13R1.14 NNC(=O)CCc1ccc(cc1)O Amb10072408 [0,1,0,0,1,0|2,0,0]=4 1867 B13R1.14 Nc1ccc(CCC(=O)NN)cc1 Amb23247768 [0,1,0,0,1,0|2,0,0]=4 1868 B13R1.14 Nc1ccc(CCC(=O)NO)cc1 Amb24494088 [0,1,0,0,1,0|2,0,0]=4 1869 B13R1.14 O=C(CBr)CCc1ccc(I)cc1 Amb24184078 [0,1,0,0,1,0|2,0,0]=4 1870 B13R1.14 OCC(=O)CCc1ccc(Br)cc1 Amb18071391 [0,1,0,0,1,0|2,0,0]=4 1871 B13R1.14 OCC(=O)CCc1ccc(Cl)cc1 Amb18566076 [0,1,0,0,1,0|2,0,0]=4 1872 B13R1.14 OCC(=O)CCc1ccc(F)cc1 Amb18066060 [0,1,0,0,1,0|2,0,0]=4 1873 B13R1.14 ONC(=O)CCc1ccc(F)cc1 Amb25845754 [0,1,0,0,1,0|2,0,0]=4 1874 B13R1.15 C#CC(=O)CCc1cccc(N)c1 Amb25155911 [0,1,0,0,1,0|1,0,1]=4 1875 B13R1.15 CCC(=O)COc1cc(N)ccc1 Amb22010109 [0,1,0,0,1,0|2,0,0]=4 1876 B13R1.15 CCC(=O)NCc1cc(N)ccc1 Amb18992892 [0,1,0,0,1,0|2,0,0]=4 1877 B13R1.15 CCC(=O)NCc1cc(O)ccc1 Amb18180918 [0,1,0,0,1,0|2,0,0]=4 1878 B13R1.15 CCC(=O)NCc1cccc(c1)Br Amb2085744 [0,1,0,0,1,0|2,0,0]=4 1879 B13R1.15 CCC(=O)NCc1cccc(c1)Cl Amb2023613 [0,1,0,0,1,0|2,0,0]=4 1880 B13R1.15 CNC(=O)CCc1c[n]cc(O)c1 Amb25734350 [0,1,0,0,1,0|2,0,0]=4 1881 B13R1.15 CNC(=O)CCc1cccc(N)c1 Amb19959906 [0,1,0,0,1,0|1,0,0]=3 1882 B13R1.15 CNC(=O)CCc1cccc(c1)N Amb17622196 [0,1,0,0,1,0|1,0,0]=3 1883 B13R1.15 CNC(=O)COc1cccc(c1)C Amb2040394 [0,1,0,0,1,0|2,0,0]=4 1884 B13R1.15 CNC(=O)COc1cccc(c1)F Amb2131085 [0,1,0,0,1,0|2,0,0]=4 1885 B13R1.15 CNC(=O)CSc1cccc(Br)c1 Amb25135883 [0,1,0,0,1,0|2,0,0]=4 1886 B13R1.15 CNC(=O)CSc1cccc(F)c1 Amb25271195 [0,1,0,0,1,0|2,0,0]=4 1887 B13R1.15 CNC(=O)CSc1cccc(N)c1 Amb25288027 [0,1,0,0,1,0|2,0,0]=4 1888 B13R1.15 CNC(=O)NCc1cccc(Cl)c1 Amb22584233 [0,1,0,0,1,0|2,0,0]=4 1889 B13R1.15 CNC(=O)NCc1cccc(N)c1 Amb25369261 [0,1,0,0,1,0|2,0,0]=4 1890 B13R1.15 CNC(=O)NCc1cccc(O)c1 Amb25848066 [0,1,0,0,1,0|2,0,0]=4 1891 B13R1.15 CNC(=O)NCc1cccc(c1)Br Amb15366176 [0,1,0,0,1,0|2,0,0]=4 1892 B13R1.15 CNC(=O)OCc1cccc(Cl)c1 Amb22460565 [0,1,0,0,1,0|2,0,0]=4 1893 B13R1.15 COC(=N)CCc1cccc(Br)c1 Amb18071178 [0,1,0,0,1,0|1,0,0]=3 1894 B13R1.15 COC(=N)CCc1cccc(Cl)c1 Amb18066444 [0,1,0,0,1,0|1,0,0]=3 1895 B13R1.15 COC(=N)CCc1cccc(F)c1 Amb18564164 [0,1,0,0,1,0|1,0,0]=3 1896 B13R1.15 COC(=N)COc1cccc(Br)c1 Amb18577246 [0,1,0,0,1,0|2,0,0]=4 1897 B13R1.15 COC(=N)COc1cccc(Cl)c1 Amb18066508 [0,1,0,0,1,0|2,0,0]=4 1898 B13R1.15 COC(=N)COc1cccc(F)c1 Amb18066093 [0,1,0,0,1,0|2,0,0]=4 1899 B13R1.15 COC(=O)/C=C/c1cccc(Cl)c1 Amb17844464 [0,1,0,0,1,0|0,0,2]=4 1900 B13R1.15 COC(=O)C#Cc1cc(F)ccc1 Amb25726243 [0,1,0,0,1,0|0,0,2]=4 1901 B13R1.15 COC(=O)C=Cc1cccc(O)c1 Amb24098382 [0,1,0,0,1,0|0,0,2]=4 1902 B13R1.15 COC(=O)CCc1cc[n]c(N)c1 Amb24105504 [0,1,0,0,1,0|1,0,0]=3 1903 B13R1.15 COC(=O)CCc1cccc(N)c1 Amb18648245 [0,1,0,0,1,0|0,0,0]=2 1904 B13R1.15 COC(=O)CCc1cccc(c1)Br Amb17410710 [0,1,0,0,1,0|0,0,0]=2 1905 B13R1.15 COC(=O)CCc1cccc(c1)C Amb17400661 [0,1,0,0,1,0|0,0,0]=2 1906 B13R1.15 COC(=O)CCc1cccc(c1)Cl Amb17402276 [0,1,0,0,1,0|0,0,0]=2 1907 B13R1.15 COC(=O)CNc1c[n]cc(N)c1 Amb25673632 [0,1,0,0,1,0|2,0,0]=4 1908 B13R1.15 COC(=O)CNc1cc(Cl)cc[n]1 Amb24751655 [0,1,0,0,1,0|2,0,0]=4 1909 B13R1.15 COC(=O)CNc1cc(N)cc[n]1 Amb18184983 [0,1,0,0,1,0|2,0,0]=4 1910 B13R1.15 COC(=O)CNc1cc[n]c(Cl)c1 Amb24427620 [0,1,0,0,1,0|2,0,0]=4 1911 B13R1.15 COC(=O)CNc1cc[n]c(N)c1 Amb25224860 [0,1,0,0,1,0|2,0,0]=4 1912 B13R1.15 COC(=O)CNc1cccc(Cl)[n]1 Amb25187972 [0,1,0,0,1,0|2,0,0]=4 1913 B13R1.15 COC(=O)CNc1cccc(F)[n]1 Amb19011125 [0,1,0,0,1,0|2,0,0]=4 1914 B13R1.15 COC(=O)COc1cc(Cl)cc[n]1 Amb22301619 [0,1,0,0,1,0|2,0,0]=4 1915 B13R1.15 COC(=O)COc1cccc(Cl)[n]1 Amb22486485 [0,1,0,0,1,0|2,0,0]=4 1916 B13R1.15 COC(=O)COc1cccc(c1)N Amb1117898 [0,1,0,0,1,0|1,0,0]=3 1917 B13R1.15 COC(=O)CSc1cc(Cl)cc[n]1 Amb22304246 [0,1,0,0,1,0|2,0,0]=4 1918 B13R1.15 COC(=O)CSc1cccc(Cl)[n]1 Amb22432540 [0,1,0,0,1,0|2,0,0]=4 1919 B13R1.15 COC(=O)CSc1cccc(N)c1 Amb19005104 [0,1,0,0,1,0|1,0,0]=3 1920 B13R1.15 COC(=O)NCC1=CC=CC(=O)N1 Amb25802747 [0,1,0,0,1,0|2,0,0]=4 1921 B13R1.15 COC(=O)NCc1cccc(F)[n]1 Amb25796147 [0,1,0,0,1,0|2,0,0]=4 1922 B13R1.15 COC(=O)NCc1cccc(F)c1 Amb24095872 [0,1,0,0,1,0|1,0,0]=3 1923 B13R1.15 COC(=O)NCc1cccc(N)c1 Amb18992199 [0,1,0,0,1,0|1,0,0]=3 1924 B13R1.15 COC(=O)NCc1cccc(O)c1 Amb18181287 [0,1,0,0,1,0|1,0,0]=3 1925 B13R1.15 COC(=O)NCc1cccc(c1)Br Amb2135033 [0,1,0,0,1,0|1,0,0]=3 1926 B13R1.15 COC(=O)NCc1cccc(c1)Cl Amb2023614 [0,1,0,0,1,0|1,0,0]=3 1927 B13R1.15 COC(=O)NNc1cc(Br)ccc1 Amb24369850 [0,1,0,0,1,0|2,0,0]=4 1928 B13R1.15 COC(=O)NNc1cc(Cl)ccc1 Amb24529772 [0,1,0,0,1,0|2,0,0]=4 1929 B13R1.15 COC(=O)\C=C\c1cccc(N)c1 Amb18127872 [0,1,0,0,1,0|0,0,2]=4 1930 B13R1.15 COC(=O)\C=C\c1cccc(O)c1 Amb18128083 [0,1,0,0,1,0|0,0,2]=4 1931 B13R1.15 COC(=O)\C=C\c1cccc(c1)Br Amb2407728 [0,1,0,0,1,0|0,0,2]=4 1932 B13R1.15 COC(=O)\C=C\c1cccc(c1)F Amb10839543 [0,1,0,0,1,0|0,0,2]=4 1933 B13R1.15 COC(=O)\N=C\c1cccc(F)c1 Amb24095903 [0,1,0,0,1,0|1,0,1]=4 1934 B13R1.15 Cc1cc(CCC(=N)OC)ccc1 Amb18065695 [0,1,0,0,1,0|1,0,0]=3 1935 B13R1.15 Cc1cc(CCC(=O)CN)ccc1 Amb18065722 [0,1,0,0,1,0|2,0,0]=4 1936 B13R1.15 Cc1cc(CCC(=O)CO)ccc1 Amb18065753 [0,1,0,0,1,0|2,0,0]=4 1937 B13R1.15 Cc1cc(CCC(=O)NN)ccc1 Amb18809074 [0,1,0,0,1,0|2,0,0]=4 1938 B13R1.15 Cc1cc(CCC(=O)NO)ccc1 Amb18186322 [0,1,0,0,1,0|2,0,0]=4 1939 B13R1.15 Cc1cc(CNC(=O)CC)ccc1 Amb23088363 [0,1,0,0,1,0|2,0,0]=4 1940 B13R1.15 Cc1cc(CNC(=O)NC)ccc1 Amb24677323 [0,1,0,0,1,0|2,0,0]=4 1941 B13R1.15 Cc1cc(CNC(=O)OC)ccc1 Amb25133958 [0,1,0,0,1,0|1,0,0]=3 1942 B13R1.15 Cc1cc(COC(=O)NC)ccc1 Amb24418396 [0,1,0,0,1,0|2,0,0]=4 1943 B13R1.15 Cc1cc(\C=N\C(=O)OC)ccc1 Amb24095904 [0,1,0,0,1,0|1,0,1]=4 1944 B13R1.15 Cc1cc(ccc1)OCC(=N)OC Amb18065838 [0,1,0,0,1,0|2,0,0]=4 1945 B13R1.15 Cc1cc(ccc1)SCC(=O)NC Amb24404352 [0,1,0,0,1,0|2,0,0]=4 1946 B13R1.15 Cc1cc(ccc1)SCC(=O)OC Amb18318073 [0,1,0,0,1,0|1,0,0]=3 1947 B13R1.15 Cc1cc[n]c(CNC(=O)OC)c1 Amb24552288 [0,1,0,0,1,0|2,0,0]=4 1948 B13R1.15 Cc1cc[n]c(c1)NCC(=O)OC Amb18184698 [0,1,0,0,1,0|2,0,0]=4 1949 B13R1.15 Cc1cccc(CNC(=O)OC)[n]1 Amb24095901 [0,1,0,0,1,0|2,0,0]=4 1950 B13R1.15 Cc1cccc(NCC(=O)OC)[n]1 Amb18796228 [0,1,0,0,1,0|2,0,0]=4 1951 B13R1.15 ClCC(=O)CCc1cccc(c1)Br Amb17163905 [0,1,0,0,1,0|2,0,0]=4 1952 B13R1.15 ClCC(=O)CCc1cccc(c1)C Amb17139633 [0,1,0,0,1,0|2,0,0]=4 1953 B13R1.15 ClCC(=O)CCc1cccc(c1)Cl Amb17141005 [0,1,0,0,1,0|2,0,0]=4 1954 B13R1.15 NCC(=O)CCc1cccc(Br)c1 Amb18727294 [0,1,0,0,1,0|2,0,0]=4 1955 B13R1.15 NCC(=O)CCc1cccc(Cl)c1 Amb18066460 [0,1,0,0,1,0|2,0,0]=4 1956 B13R1.15 NCC(=O)CCc1cccc(F)c1 Amb18066017 [0,1,0,0,1,0|2,0,0]=4 1957 B13R1.15 NNC(=O)CCc1cccc(F)c1 Amb24730788 [0,1,0,0,1,0|2,0,0]=4 1958 B13R1.15 Nc1cc(CCC(=O)NN)ccc1 Amb25719001 [0,1,0,0,1,0|2,0,0]=4 1959 B13R1.15 OCC(=O)CCc1cccc(Br)c1 Amb18072015 [0,1,0,0,1,0|2,0,0]=4 1960 B13R1.15 OCC(=O)CCc1cccc(Cl)c1 Amb18066486 [0,1,0,0,1,0|2,0,0]=4 1961 B13R1.15 OCC(=O)CCc1cccc(F)c1 Amb18066059 [0,1,0,0,1,0|2,0,0]=4 1962 B13R1.135 C=CC(=O)C(Cc1ccccc1)O Amb10562284 [0,1,0,0,1,0|1,0,1]=4 1963 B13R1.135 CC(Cc1ccccc1)C(=O)C#N Amb24492792 [0,1,0,0,1,0|2,0,0]=4 1964 B13R1.135 CC(Cc1ccccc1)C(=O)NN Amb24501376 [0,1,0,0,1,0|2,0,0]=4 1965 B13R1.135 CCC(=O)C(Cc1ccccc1)C Amb17233202 [0,1,0,0,1,0|1,0,0]=3 1966 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,1,0|1,0,1]=4 1967 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,1,0,0,1,0|1,0,0]=3 1968 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,1,0,0,1,0|1,0,0]=3 1969 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,1,0|1,0,0]=3 1970 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,1,0,0,1,0|1,0,0]=3 1971 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,1,0,0,1,0|1,0,0]=3 1972 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,1,0,0,1,0|1,0,0]=3 1973 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,1,0,0,1,0|1,0,0]=3 1974 B13R1.135 CNC(=O)[C@H](C)Nc1ccccc1 Amb25268956 [0,1,0,0,1,0|2,0,0]=4 1975 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,1,0,0,1,0|1,0,0]=3 1976 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,1,0,0,1,0|1,0,0]=3 1977 B13R1.135 CNC(=S)C(C)Cc1ccccc1 Amb24710289 [0,1,0,0,1,0|1,1,0]=4 1978 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,1,0|0,0,1]=3 1979 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,1,0|1,0,1]=4 1980 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,1,0|1,0,1]=4 1981 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,1,0|1,0,1]=4 1982 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,0,0,1,0|1,0,1]=4 1983 B13R1.135 COC(=O)C(C)Nc1ccc[n]c1 Amb18270387 [0,1,0,0,1,0|2,0,0]=4 1984 B13R1.135 COC(=O)C(Cc1ccccc1)Cl Amb17204377 [0,1,0,0,1,0|0,0,0]=2 1985 B13R1.135 COC(=O)C(Cc1ccccc1)N Amb1779248 [0,1,0,0,1,0|0,0,0]=2 1986 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,1,0,0,1,0|0,0,0]=2 1987 B13R1.135 COC(=O)C(Cc1ccccn1)O Amb17138998 [0,1,0,0,1,0|1,0,0]=3 1988 B13R1.135 COC(=O)C(Cc1cccnc1)O Amb17138999 [0,1,0,0,1,0|1,0,0]=3 1989 B13R1.135 COC(=O)C(Cc1ccncc1)O Amb17139000 [0,1,0,0,1,0|1,0,0]=3 1990 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,1,0|0,0,0]=2 1991 B13R1.135 COC(=O)[C@@H](Cc1cccnc1)N Amb15691971 [0,1,0,0,1,0|1,0,0]=3 1992 B13R1.135 COC(=O)[C@@H](N)Cc1ccc[n]c1 Amb22756662 [0,1,0,0,1,0|1,0,0]=3 1993 B13R1.135 COC(=O)[C@@H](N)Cc1cccc[n]1 Amb22745828 [0,1,0,0,1,0|1,0,0]=3 1994 B13R1.135 COC(=O)[C@H](C)Nc1ccccc1 Amb25732039 [0,1,0,0,1,0|1,0,0]=3 1995 B13R1.135 COC(=O)\C(\Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,1,0|0,0,2]=4 1996 B13R1.135 COC(=O)\C(\F)=C\c1ccccc1 Amb25706644 [0,1,0,0,1,0|0,0,2]=4 1997 B13R1.135 C[C@@H](Cc1ccccc1)C(=O)NO Amb24408073 [0,1,0,0,1,0|2,0,0]=4 1998 B13R1.135 C[C@H](Cc1ccccc1)C(=O)C#C Amb24379008 [0,1,0,0,1,0|1,0,1]=4 1999 B13R1.135 C[C@H](Cc1ccccc1)C(=O)NO Amb25370073 [0,1,0,0,1,0|2,0,0]=4 2000 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,1,0|2,0,0]=4 2001 B13R1.135 NNC(=O)C(Cc1ccccc1)N Amb16231875 [0,1,0,0,1,0|2,0,0]=4 2002 B13R1.135 NNC(=O)C(O)Cc1ccccc1 Amb25129792 [0,1,0,0,1,0|2,0,0]=4 2003 B13R1.135 NNC(=O)C(S)Cc1ccccc1 Amb24501331 [0,1,0,0,1,0|2,0,0]=4 2004 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb22800040 [0,1,0,0,1,0|2,0,0]=4 2005 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)NO Amb25268143 [0,1,0,0,1,0|2,0,0]=4 2006 B13R1.135 N[C@H](Cc1ccccc1)C(=O)CCl Amb20243107 [0,1,0,0,1,0|2,0,0]=4 2007 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,1,0,0,1,0|2,0,0]=4 2008 B13R1.417 CN\C(\CCc1ccccc1)=N/C Amb25155427 [0,1,0,0,1,0|2,0,0]=4 2009 B13R1.417 CN\C(\CCc1ccccc1)=N/N Amb18178423 [0,1,0,0,1,0|2,0,0]=4 2010 B13R1.417 COC(=CCc1ccccc1)OC Amb22546894 [0,1,0,0,1,0|0,0,2]=4 2011 B13R1.417 CO\C(\C=O)=C\Nc1ccccc1 Amb24564475 [0,1,0,0,1,0|1,0,1]=4 2012 B13R1.417 CO\C(\NCc1ccccc1)=N\O Amb25261904 [0,1,0,0,1,0|1,0,1]=4 2013 B13R1.417 C\N=C(/NCc1ccccc1)\OC Amb25799514 [0,1,0,0,1,0|2,0,0]=4 2014 B13R1.528 CCC(=O)COc1ccccc1N Amb22010341 [0,1,0,0,1,0|2,0,0]=4 2015 B13R1.528 CCC(=O)NCc1ccccc1Br Amb2085745 [0,1,0,0,1,0|2,0,0]=4 2016 B13R1.528 CCC(=O)NCc1ccccc1C Amb10672025 [0,1,0,0,1,0|2,0,0]=4 2017 B13R1.528 CCC(=O)NCc1ccccc1F Amb2020111 [0,1,0,0,1,0|2,0,0]=4 2018 B13R1.528 CCC(=O)NCc1ccccc1N Amb18984726 [0,1,0,0,1,0|2,0,0]=4 2019 B13R1.528 CNC(=O)CCc1ccccc1Br Amb22098933 [0,1,0,0,1,0|1,0,0]=3 2020 B13R1.528 CNC(=O)CCc1ccccc1Cl Amb13957943 [0,1,0,0,1,0|1,0,0]=3 2021 B13R1.528 CNC(=O)CCc1ccccc1F Amb23163929 [0,1,0,0,1,0|1,0,0]=3 2022 B13R1.528 CNC(=O)COc1ccccc1Br Amb1174422 [0,1,0,0,1,0|2,0,0]=4 2023 B13R1.528 CNC(=O)COc1ccccc1C Amb2089063 [0,1,0,0,1,0|2,0,0]=4 2024 B13R1.528 CNC(=O)COc1ccccc1F Amb2131087 [0,1,0,0,1,0|2,0,0]=4 2025 B13R1.528 CNC(=O)COc1ccccc1I Amb24343727 [0,1,0,0,1,0|2,0,0]=4 2026 B13R1.528 CNC(=O)COc1ccccc1N Amb1121495 [0,1,0,0,1,0|2,0,0]=4 2027 B13R1.528 CNC(=O)COc1ccccc1O Amb1199497 [0,1,0,0,1,0|2,0,0]=4 2028 B13R1.528 CNC(=O)CSc1ccccc1Br Amb11254390 [0,1,0,0,1,0|2,0,0]=4 2029 B13R1.528 CNC(=O)CSc1ccccc1O Amb18318226 [0,1,0,0,1,0|2,0,0]=4 2030 B13R1.528 CNC(=O)NCc1ccccc1Cl Amb2132766 [0,1,0,0,1,0|2,0,0]=4 2031 B13R1.528 CNC(=O)NCc1ccccc1F Amb22584226 [0,1,0,0,1,0|2,0,0]=4 2032 B13R1.528 CNC(=O)OCc1ccccc1Br Amb25239936 [0,1,0,0,1,0|2,0,0]=4 2033 B13R1.528 CNC(=O)SCc1ccccc1Cl Amb25095777 [0,1,0,0,1,0|2,0,0]=4 2034 B13R1.528 COC(=N)CCc1ccccc1Br Amb18071214 [0,1,0,0,1,0|1,0,0]=3 2035 B13R1.528 COC(=N)CCc1ccccc1Cl Amb18066439 [0,1,0,0,1,0|1,0,0]=3 2036 B13R1.528 COC(=N)CCc1ccccc1F Amb18066000 [0,1,0,0,1,0|1,0,0]=3 2037 B13R1.528 COC(=N)COc1ccccc1Br Amb18577242 [0,1,0,0,1,0|2,0,0]=4 2038 B13R1.528 COC(=N)COc1ccccc1Cl Amb18066507 [0,1,0,0,1,0|2,0,0]=4 2039 B13R1.528 COC(=N)COc1ccccc1F Amb18066092 [0,1,0,0,1,0|2,0,0]=4 2040 B13R1.528 COC(=O)C=Cc1ccccc1O Amb10605440 [0,1,0,0,1,0|0,0,2]=4 2041 B13R1.528 COC(=O)CCC1=CN=CNC1=O Amb23248036 [0,1,0,0,1,0|2,0,0]=4 2042 B13R1.528 COC(=O)CCc1ccccc1Br Amb10604254 [0,1,0,0,1,0|0,0,0]=2 2043 B13R1.528 COC(=O)CCc1ccccc1C Amb17400660 [0,1,0,0,1,0|0,0,0]=2 2044 B13R1.528 COC(=O)CCc1ccccc1Cl Amb17402275 [0,1,0,0,1,0|0,0,0]=2 2045 B13R1.528 COC(=O)CCc1ccccc1F Amb17400908 [0,1,0,0,1,0|0,0,0]=2 2046 B13R1.528 COC(=O)CNc1[n]cccc1F Amb18314018 [0,1,0,0,1,0|2,0,0]=4 2047 B13R1.528 COC(=O)CNc1cc[n]cc1Br Amb25820167 [0,1,0,0,1,0|2,0,0]=4 2048 B13R1.528 COC(=O)CNc1cc[n]cc1Cl Amb24378605 [0,1,0,0,1,0|2,0,0]=4 2049 B13R1.528 COC(=O)CNc1ccc[n]c1N Amb24472644 [0,1,0,0,1,0|2,0,0]=4 2050 B13R1.528 COC(=O)CNc1ccccc1Cl Amb24099081 [0,1,0,0,1,0|1,0,0]=3 2051 B13R1.528 COC(=O)CNc1ccccc1O Amb25360835 [0,1,0,0,1,0|1,0,0]=3 2052 B13R1.528 COC(=O)COc1[n]cccc1O Amb24095895 [0,1,0,0,1,0|2,0,0]=4 2053 B13R1.528 COC(=O)COc1ccccc1N Amb1119918 [0,1,0,0,1,0|1,0,0]=3 2054 B13R1.528 COC(=O)CSc1[n]cccc1O Amb24095896 [0,1,0,0,1,0|2,0,0]=4 2055 B13R1.528 COC(=O)CSc1ccccc1O Amb19044958 [0,1,0,0,1,0|1,0,0]=3 2056 B13R1.528 COC(=O)CSc1ncccc1Cl Amb11262003 [0,1,0,0,1,0|2,0,0]=4 2057 B13R1.528 COC(=O)NCc1ccc[n]c1F Amb25069490 [0,1,0,0,1,0|2,0,0]=4 2058 B13R1.528 COC(=O)NCc1ccccc1Br Amb24643282 [0,1,0,0,1,0|1,0,0]=3 2059 B13R1.528 COC(=O)NCc1ccccc1Cl Amb22469956 [0,1,0,0,1,0|1,0,0]=3 2060 B13R1.528 COC(=O)NCc1ccccc1F Amb2020112 [0,1,0,0,1,0|1,0,0]=3 2061 B13R1.528 COC(=O)NNc1ccccc1Cl Amb24510177 [0,1,0,0,1,0|2,0,0]=4 2062 B13R1.528 COC(=O)NNc1ccccc1F Amb24612816 [0,1,0,0,1,0|2,0,0]=4 2063 B13R1.528 COC(=O)\C=C\c1ccccc1Br Amb22491743 [0,1,0,0,1,0|0,0,2]=4 2064 B13R1.528 COC(=O)\C=C\c1ccccc1Cl Amb10808396 [0,1,0,0,1,0|0,0,2]=4 2065 B13R1.528 COC(=O)\C=C\c1ccccc1F Amb2432760 [0,1,0,0,1,0|0,0,2]=4 2066 B13R1.528 COC(=O)\C=C\c1ccccc1I Amb25275412 [0,1,0,0,1,0|0,0,2]=4 2067 B13R1.528 COC(=O)\C=C\c1ccccc1N Amb18127873 [0,1,0,0,1,0|0,0,2]=4 2068 B13R1.528 C\C(\CCc1ccccc1O)=C/C Amb24647804 [0,1,0,0,1,0|2,0,0]=4 2069 B13R1.528 C\C(\CCc1ccccc1O)=C\C Amb25271017 [0,1,0,0,1,0|2,0,0]=4 2070 B13R1.528 Cc1ccc[n]c1NCC(=O)OC Amb18809312 [0,1,0,0,1,0|2,0,0]=4 2071 B13R1.528 Cc1ccccc1CCC(=N)OC Amb18065690 [0,1,0,0,1,0|1,0,0]=3 2072 B13R1.528 Cc1ccccc1CCC(=O)C#C Amb25134938 [0,1,0,0,1,0|1,0,1]=4 2073 B13R1.528 Cc1ccccc1CCC(=O)CN Amb18564059 [0,1,0,0,1,0|2,0,0]=4 2074 B13R1.528 Cc1ccccc1CCC(=O)CO Amb18065752 [0,1,0,0,1,0|2,0,0]=4 2075 B13R1.528 Cc1ccccc1CCC(=O)NO Amb18804872 [0,1,0,0,1,0|2,0,0]=4 2076 B13R1.528 Cc1ccccc1OCC(=N)OC Amb18065837 [0,1,0,0,1,0|2,0,0]=4 2077 B13R1.528 ClCC(=O)CCc1ccccc1C Amb17139632 [0,1,0,0,1,0|2,0,0]=4 2078 B13R1.528 ClCC(=O)CCc1ccccc1Cl Amb17141004 [0,1,0,0,1,0|2,0,0]=4 2079 B13R1.528 ClCC(=O)CCc1ccccc1F Amb17139826 [0,1,0,0,1,0|2,0,0]=4 2080 B13R1.528 NCC(=O)CCc1ccccc1Br Amb18156124 [0,1,0,0,1,0|2,0,0]=4 2081 B13R1.528 NCC(=O)CCc1ccccc1Cl Amb18066458 [0,1,0,0,1,0|2,0,0]=4 2082 B13R1.528 NNC(=O)CCc1ccccc1Br Amb24729756 [0,1,0,0,1,0|2,0,0]=4 2083 B13R1.528 NNC(=O)CCc1ccccc1O Amb1625126 [0,1,0,0,1,0|2,0,0]=4 2084 B13R1.528 O=C(CCl)CCc1ccccc1Br Amb22375373 [0,1,0,0,1,0|2,0,0]=4 2085 B13R1.528 OCC(=O)CCc1ccccc1Br Amb18576942 [0,1,0,0,1,0|2,0,0]=4 2086 B13R1.528 OCC(=O)CCc1ccccc1Cl Amb18066485 [0,1,0,0,1,0|2,0,0]=4 2087 B13R1.528 OCC(=O)CCc1ccccc1F Amb18564200 [0,1,0,0,1,0|2,0,0]=4 2088 B13R1.528 ONC(=O)CCc1ccccc1F Amb25762731 [0,1,0,0,1,0|2,0,0]=4 2089 B13R1.162 CNC(=O)CCC(c1cccs1)O Amb17337424 [0,1,0,0,1,0|2,0,0]=4 2090 B13R1.162 COC(=O)CCC(=O)c1cccs1 Amb17337310 [0,1,0,0,1,0|1,0,1]=4 2091 B13R1.404 CCCC(=O)CCCc1ccco1 Amb17233692 [0,1,0,0,1,0|2,0,0]=4 2092 B13R1.404 CCCC(=O)CCCc1cccs1 Amb17236459 [0,1,0,0,1,0|2,0,0]=4 2093 B13R1.404 CCOC(=O)CCCc1cc[s]c1 Amb22494757 [0,1,0,0,1,0|1,0,0]=3 2094 B13R1.404 CCOC(=O)CNCc1cc[s]c1 Amb19056636 [0,1,0,0,1,0|2,0,0]=4 2095 B13R1.404 CCOC(=O)COCc1cc[s]c1 Amb22896687 [0,1,0,0,1,0|2,0,0]=4 2096 B13R1.404 CCOC(=O)NCCc1ccoc1 Amb22643619 [0,1,0,0,1,0|2,0,0]=4 2097 B13R1.404 CCOC(=O)NCCc1cscc1 Amb13799084 [0,1,0,0,1,0|2,0,0]=4 2098 B13R1.404 COCC(=O)NCCc1cscc1 Amb13821365 [0,1,0,0,1,0|2,0,0]=4 2099 B13R1.404 CONC(=O)NCCc1cccs1 Amb11298281 [0,1,0,0,1,0|2,0,0]=4 2100 B13R1.545 COC(=O)CC(=O)Cc1cscc1 Amb13893688 [0,1,0,0,1,0|1,0,1]=4 2101 B13R1.545 COC(=O)CC(O)Cc1cc[s]c1 Amb22296226 [0,1,0,0,1,0|1,0,0]=3 2102 B13R1.545 COC(=O)CS(=O)Cc1ccco1 Amb22225102 [0,1,0,0,1,0|2,0,0]=4 2103 B13R1.545 COC(=O)C[C@@H](C)Sc1ccc[s]1 Amb22746491 [0,1,0,0,1,0|2,0,0]=4 2104 B13R1.545 COC(=O)NC(C)Cc1ccoc1 Amb22710595 [0,1,0,0,1,0|2,0,0]=4 2105 B13R1.545 COC(=O)NC(Cc1ccco1)C Amb13837832 [0,1,0,0,1,0|2,0,0]=4 2106 B13R1.599 COC(=O)CCC[n]1[n]ccc1Br Amb23539606 [0,1,0,0,1,0|2,0,0]=4 2107 B13R1.599 COC(=O)CCC[n]1[n]ccc1Cl Amb23539605 [0,1,0,0,1,0|2,0,0]=4 2108 B13R1.599 COC(=O)CCSc1[s]ccc1N Amb19929917 [0,1,0,0,1,0|2,0,0]=4 2109 B13R1.717 COC(=O)CCCc1c[s]c(N)[n]1 Amb20667848 [0,1,0,0,1,0|2,0,0]=4 2110 B13R1.1110 O=C(N(C)C)CCCc1cccs1 Amb15739656 [0,1,0,0,1,0|2,0,0]=4 2111 B15R1.26 CCC(=O)CCCCc1ccc(cc1)Br Amb17273846 [0,1,0,0,0,1|1,0,0]=3 2112 B15R1.26 CCC(=O)CCCCc1ccc(cc1)C Amb17238176 [0,1,0,0,0,1|1,0,0]=3 2113 B15R1.26 CCC(=O)CCCCc1ccc(cc1)Cl Amb17246787 [0,1,0,0,0,1|1,0,0]=3 2114 B15R1.26 CCC(=O)CCCCc1ccc(cc1)F Amb17239886 [0,1,0,0,0,1|1,0,0]=3 2115 B15R1.26 CCC(=O)NCCCc1ccc(Cl)cc1 Amb19455814 [0,1,0,0,0,1|1,0,0]=3 2116 B15R1.26 CCC(=O)NCCCc1ccc(F)cc1 Amb23088837 [0,1,0,0,0,1|1,0,0]=3 2117 B15R1.26 CCC(=O)NCCSc1ccc(Cl)cc1 Amb20726857 [0,1,0,0,0,1|2,0,0]=4 2118 B15R1.26 CCC(=O)NCCSc1ccc(cc1)C Amb10615450 [0,1,0,0,0,1|2,0,0]=4 2119 B15R1.26 CNC(=O)CCCOc1ccc(Cl)cc1 Amb21760339 [0,1,0,0,0,1|1,0,0]=3 2120 B15R1.26 CNC(=O)CCCSc1ccc(Br)cc1 Amb19501154 [0,1,0,0,0,1|1,0,0]=3 2121 B15R1.26 CNC(=O)CCCSc1ccc(cc1)Cl Amb17625709 [0,1,0,0,0,1|1,0,0]=3 2122 B15R1.26 CNC(=O)CCNCc1ccc(Br)cc1 Amb19451284 [0,1,0,0,0,1|1,0,0]=3 2123 B15R1.26 COC(=O)CCCCc1ccc(O)cc1 Amb22490523 [0,1,0,0,0,1|0,0,0]=2 2124 B15R1.26 COC(=O)CCCOc1ccc(N)cc1 Amb19373667 [0,1,0,0,0,1|0,0,0]=2 2125 B15R1.26 COC(=O)\C=C\CCc1ccc(F)cc1 Amb22057547 [0,1,0,0,0,1|0,0,1]=3 2126 B15R1.26 Cc1ccc(CCC#CC(=O)OC)cc1 Amb25737671 [0,1,0,0,0,1|0,0,1]=3 2127 B15R1.26 Cc1ccc(CCCNC(=O)CC)cc1 Amb23094546 [0,1,0,0,0,1|1,0,0]=3 2128 B15R1.26 Cc1ccc(cc1)NCCCC(=O)NN Amb22540439 [0,1,0,0,0,1|2,0,0]=4 2129 B15R1.26 ONC(=O)CCCOc1ccc(Cl)cc1 Amb22039474 [0,1,0,0,0,1|2,0,0]=4 2130 B15R1.452 COC(CCOCc1ccccc1)OC Amb22236053 [0,1,0,0,0,1|0,0,2]=4 2131 B15R1.452 COC(CN)CCNCc1ccccc1 Amb24653404 [0,1,0,0,0,1|1,0,1]=4 2132 B15R1.741 CC(CCc1ccccc1)NC(=O)CN Amb24770585 [0,1,0,0,0,1|2,0,0]=4 2133 B15R1.741 CCC(=O)CC(=O)NCc1ccccc1 Amb25840333 [0,1,0,0,0,1|1,0,1]=4 2134 B15R1.741 CCC(=O)NC(C)COc1ccccc1 Amb19558448 [0,1,0,0,0,1|2,0,0]=4 2135 B15R1.741 CNC(=O)CC(C)NCc1ccccc1 Amb24517876 [0,1,0,0,0,1|1,0,0]=3 2136 B15R1.741 CNC(=O)C[C@@H](N)CSc1ccccc1 Amb22746582 [0,1,0,0,0,1|1,0,0]=3 2137 B15R1.741 CNC(=O)NC(CCc1ccccc1)C Amb11258719 [0,1,0,0,0,1|1,0,0]=3 2138 B15R1.741 COC(=O)CC(=O)COc1ccccc1 Amb13893681 [0,1,0,0,0,1|0,0,1]=3 2139 B15R1.741 COC(=O)CC(=O)CSc1ccccc1 Amb2182878 [0,1,0,0,0,1|0,0,1]=3 2140 B15R1.741 COC(=O)CC(=O)CSc1ccccn1 Amb13893683 [0,1,0,0,0,1|1,0,1]=4 2141 B15R1.741 COC(=O)CC(=O)OCc1ccccc1 Amb19958253 [0,1,0,0,0,1|0,0,1]=3 2142 B15R1.741 COC(=O)CC(N)/C=C/c1ccccc1 Amb17779495 [0,1,0,0,0,1|0,0,1]=3 2143 B15R1.741 COC(=O)C[C@@H](C)OCc1ccccc1 Amb22746492 [0,1,0,0,0,1|0,0,0]=2 2144 B15R1.741 COC(=O)NC(=O)NCc1ccccc1 Amb25743453 [0,1,0,0,0,1|1,0,1]=4 2145 B15R1.741 ClCC(=O)NC(CCc1ccccc1)C Amb1644306 [0,1,0,0,0,1|2,0,0]=4 2146 B15R1.778 CCCC(=O)CCOCc1ccccc1 Amb25227588 [0,1,0,0,0,1|1,0,0]=3 2147 B15R1.778 CCCC(=O)NCCOc1ccccc1 Amb13955603 [0,1,0,0,0,1|2,0,0]=4 2148 B15R1.778 CCCC(=O)OCCCc1ccccc1 Amb22732786 [0,1,0,0,0,1|1,0,0]=3 2149 B15R1.778 CCCC(=O)OCCOc1ccccc1 Amb21964300 [0,1,0,0,0,1|2,0,0]=4 2150 B15R1.778 CCNC(=N)CCOCc1ccccc1 Amb24546807 [0,1,0,0,0,1|2,0,0]=4 2151 B15R1.778 CCNC(=O)CCNCc1ccc[n]c1 Amb20171991 [0,1,0,0,0,1|2,0,0]=4 2152 B15R1.778 CCNC(=O)CCNCc1ccccc1 Amb20171948 [0,1,0,0,0,1|1,0,0]=3 2153 B15R1.778 CCNC(=O)CCSCc1ccccc1 Amb20226710 [0,1,0,0,0,1|1,0,0]=3 2154 B15R1.778 CCNC(=O)CNOCc1ccccc1 Amb24370292 [0,1,0,0,0,1|2,0,0]=4 2155 B15R1.778 CCNC(=O)NCCOc1ccccc1 Amb11223918 [0,1,0,0,0,1|2,0,0]=4 2156 B15R1.778 CCNC(=O)NCCSc1ccccc1 Amb11266459 [0,1,0,0,0,1|2,0,0]=4 2157 B15R1.778 CCOC(=O)CCCNc1[n]ccc[n]1 Amb24056226 [0,1,0,0,0,1|2,0,0]=4 2158 B15R1.778 CCOC(=O)CCCNc1c[n]cc[n]1 Amb24056224 [0,1,0,0,0,1|2,0,0]=4 2159 B15R1.778 CCOC(=O)CCCNc1cccc[n]1 Amb24056225 [0,1,0,0,0,1|1,0,0]=3 2160 B15R1.778 CCOC(=O)CCCNc1ccccc1 Amb22540438 [0,1,0,0,0,1|0,0,0]=2 2161 B15R1.778 CCOC(=O)CCCOc1ccccc1 Amb22730739 [0,1,0,0,0,1|0,0,0]=2 2162 B15R1.778 CCOC(=O)CCCSc1ccccc1 Amb19888704 [0,1,0,0,0,1|0,0,0]=2 2163 B15R1.778 CCOC(=O)CCNCc1ccccc1 Amb1930738 [0,1,0,0,0,1|0,0,0]=2 2164 B15R1.778 CCOC(=O)CNOCc1ccccc1 Amb13884841 [0,1,0,0,0,1|1,0,0]=3 2165 B15R1.778 CCOC(=O)NNCCc1ccccc1 Amb24103548 [0,1,0,0,0,1|1,0,0]=3 2166 B15R1.778 CCOC(=O)\C=C/NCc1ccccc1 Amb24749367 [0,1,0,0,0,1|0,0,2]=4 2167 B15R1.778 CCOC(=O)\C=C\CCc1ccccc1 Amb10067182 [0,1,0,0,0,1|0,0,1]=3 2168 B15R1.778 CNCC(=O)NCCCc1cccc[n]1 Amb25399183 [0,1,0,0,0,1|2,0,0]=4 2169 B15R1.778 CNCC(=O)NCCCc1ccccc1 Amb24115171 [0,1,0,0,0,1|1,0,0]=3 2170 B15R1.778 CNCC(=O)NCCCc1ccccc1 Amb25388739 [0,1,0,0,0,1|1,0,0]=3 2171 B15R1.778 CNCC(=O)NCCOc1ccccc1 Amb25388737 [0,1,0,0,0,1|2,0,0]=4 2172 B15R1.778 CNCC(=O)NCCSc1ccccc1 Amb25388751 [0,1,0,0,0,1|2,0,0]=4 2173 B15R1.778 COCC(=O)NCC#Cc1ccccc1 Amb13991101 [0,1,0,0,0,1|0,0,2]=4 2174 B15R1.778 COCC(=O)NCCOc1ccccc1 Amb22269560 [0,1,0,0,0,1|1,0,0]=3 2175 B15R1.778 COCC(=O)NCCSc1ccccc1 Amb10616365 [0,1,0,0,0,1|1,0,0]=3 2176 B15R1.778 COCC(O)CCNCc1ccccc1 Amb24375561 [0,1,0,0,0,1|0,0,2]=4 2177 B15R1.778 COC[C@@H](N)CCOCc1ccccc1 Amb24674297 [0,1,0,0,0,1|1,0,1]=4 2178 B15R1.778 CONC(=O)CCNCc1ccccc1 Amb25370472 [0,1,0,0,0,1|0,0,0]=2 2179 B15R1.778 CONC(=O)NCCCc1ccccc1 Amb11298270 [0,1,0,0,0,1|0,0,0]=2 2180 B15R1.778 CONC(=O)NCCSc1ccccc1 Amb11298295 [0,1,0,0,0,1|1,0,0]=3 2181 B15R1.778 CSCC(=O)NCCCc1ccccc1 Amb15701829 [0,1,0,0,0,1|0,1,0]=3 2182 B15R1.778 CSCC(=O)NCCSc1ccccc1 Amb21625137 [0,1,0,0,0,1|1,1,0]=4 2183 B15R1.778 ClCCC(=O)NCCOc1ccccc1 Amb17326988 [0,1,0,0,0,1|2,0,0]=4 2184 B15R1.778 ClCCC(=O)NCCSc1ccccc1 Amb10975200 [0,1,0,0,0,1|2,0,0]=4 2185 B15R1.778 N#CCC(=O)CCOCc1ccccc1 Amb22754626 [0,1,0,0,0,1|1,0,1]=4 2186 B15R1.778 N#CCC(=O)NCCCc1ccccc1 Amb1948524 [0,1,0,0,0,1|1,0,1]=4 2187 B15R1.778 N#CCC(=O)OCCCc1ccccc1 Amb17210530 [0,1,0,0,0,1|1,0,1]=4 2188 B15R1.778 NCCC(=O)CCOCc1ccccc1 Amb24442130 [0,1,0,0,0,1|1,0,0]=3 2189 B15R1.778 NCCC(=O)NCCOc1ccccc1 Amb17239848 [0,1,0,0,0,1|2,0,0]=4 2190 B15R1.778 NCCC(=O)NCCOc1ccccc1 Amb24771520 [0,1,0,0,0,1|2,0,0]=4 2191 B15R1.778 O=C(CCBr)OCCCc1ccccc1 Amb24094183 [0,1,0,0,0,1|1,0,0]=3 2192 B15R1.942 CCC(=O)CCCCc1cccc(c1)Br Amb17273843 [0,1,0,0,0,1|1,0,0]=3 2193 B15R1.942 CCC(=O)CCCCc1cccc(c1)C Amb17238173 [0,1,0,0,0,1|1,0,0]=3 2194 B15R1.942 CCC(=O)CCCCc1cccc(c1)Cl Amb17246784 [0,1,0,0,0,1|1,0,0]=3 2195 B15R1.942 CNC(=O)CCCOc1cccc(Br)c1 Amb22289218 [0,1,0,0,0,1|1,0,0]=3 2196 B15R1.942 Cc1cc(CCC#CC(=O)OC)ccc1 Amb24653130 [0,1,0,0,0,1|0,0,1]=3 2197 B15R1.942 Cc1cc(CCCNC(=O)CC)ccc1 Amb23089289 [0,1,0,0,0,1|1,0,0]=3 2198 B15R1.942 Cc1cc(ccc1)NCCCC(=O)NN Amb22540441 [0,1,0,0,0,1|2,0,0]=4 2199 B15R1.942 Cc1cc(ccc1)OCCCC(=O)NC Amb22269312 [0,1,0,0,0,1|1,0,0]=3 2200 B15R1.959 BrCC(=O)NCCC(c1ccccc1)C Amb17329990 [0,1,0,0,0,1|2,0,0]=4 2201 B15R1.959 CCC(=O)NCCN(C)c1ccccc1 Amb20793667 [0,1,0,0,0,1|2,0,0]=4 2202 B15R1.959 CNC(=O)CCNC(=O)c1ccccc1 Amb1008102 [0,1,0,0,0,1|1,0,1]=4 2203 B15R1.959 CNC(=O)CCNC(C)c1ccccc1 Amb20171951 [0,1,0,0,0,1|1,0,0]=3 2204 B15R1.959 CNC(=O)CSCC(=O)c1ccccc1 Amb22445282 [0,1,0,0,0,1|1,0,1]=4 2205 B15R1.959 CNC(=O)CSCC(C)c1ccccc1 Amb24279165 [0,1,0,0,0,1|1,0,0]=3 2206 B15R1.959 COC(=O)CCCC(O)c1ccccc1 Amb18627401 [0,1,0,0,0,1|0,0,0]=2 2207 B15R1.959 COC(=O)CCNC(=O)c1cccc[n]1 Amb24058738 [0,1,0,0,0,1|1,0,1]=4 2208 B15R1.959 COC(=O)CCNC(=O)c1cccnc1 Amb13957930 [0,1,0,0,0,1|1,0,1]=4 2209 B15R1.959 COC(=O)CCNC(=O)c1ccncc1 Amb13957929 [0,1,0,0,0,1|1,0,1]=4 2210 B15R1.959 COC(=O)CCNC(C)c1ccccc1 Amb22586709 [0,1,0,0,0,1|0,0,0]=2 2211 B15R1.959 COC(=O)CNCC(=O)c1ccccc1 Amb22491332 [0,1,0,0,0,1|0,0,1]=3 2212 B15R1.959 NNC(=O)CCNC(c1ccccc1)C Amb17604771 [0,1,0,0,0,1|2,0,0]=4 2213 B15R1.964 CN(Cc1ccccc1)CCC(=O)NC Amb19558615 [0,1,0,0,0,1|1,0,0]=3 2214 B15R1.964 CN(Cc1ccccc1)CCC(=O)NN Amb20171947 [0,1,0,0,0,1|2,0,0]=4 2215 B15R1.964 CN(Cc1ccccc1)\C=C\C(=O)OC Amb25214075 [0,1,0,0,0,1|0,0,2]=4 2216 B15R1.964 COC(=O)C=CC(N)Cc1ccccc1 Amb22229642 [0,1,0,0,0,1|0,0,1]=3 2217 B15R1.964 COC(=O)CCC(=O)Nc1ccncc1 Amb1784267 [0,1,0,0,0,1|1,0,1]=4 2218 B15R1.964 COC(=O)CCC(=O)Oc1ccccc1 Amb17339000 [0,1,0,0,0,1|0,0,1]=3 2219 B15R1.964 COC(=O)CCC(N)Cc1ccccc1 Amb22059181 [0,1,0,0,0,1|0,0,0]=2 2220 B15R1.964 COC(=O)NCC(O)Cc1ccccc1 Amb21941929 [0,1,0,0,0,1|0,0,0]=2 2221 B15R1.964 COC(=O)NNC(=O)Cc1ccccc1 Amb1208315 [0,1,0,0,0,1|1,0,1]=4 2222 B15R1.964 COC(=O)\C=C\[C@H](Cc1ccccc1)N Amb10605366 [0,1,0,0,0,1|0,0,1]=3 2223 B15R1.1091 CCC(=O)CCCCc1ccccc1C Amb17238169 [0,1,0,0,0,1|1,0,0]=3 2224 B15R1.1091 CCC(=O)CCCCc1ccccc1Cl Amb17246780 [0,1,0,0,0,1|1,0,0]=3 2225 B15R1.1091 CCC(=O)CCCCc1ccccc1F Amb17239883 [0,1,0,0,0,1|1,0,0]=3 2226 B15R1.1091 CCC(=O)NCCCc1ccccc1Cl Amb23364700 [0,1,0,0,0,1|1,0,0]=3 2227 B15R1.1091 CCC(=O)NCCOc1ccccc1Cl Amb23252284 [0,1,0,0,0,1|2,0,0]=4 2228 B15R1.1091 CNC(=O)CCCOc1ccccc1Br Amb15714293 [0,1,0,0,0,1|1,0,0]=3 2229 B15R1.1091 CNC(=O)CCNCc1ccccc1Cl Amb20171988 [0,1,0,0,0,1|1,0,0]=3 2230 B15R1.1091 COC(=O)CCCSc1[n]c[n]cc1Cl Amb24283754 [0,1,0,0,0,1|2,0,0]=4 2231 B15R1.1091 COC(=O)CON=Cc1ccccc1O Amb22469819 [0,1,0,0,0,1|1,0,1]=4 2232 B15R1.1091 Cc1ccccc1OCCCC(=O)NC Amb21648298 [0,1,0,0,0,1|1,0,0]=3 2233 B15R1.1091 NNC(=O)CCNCc1ccccc1Cl Amb20171990 [0,1,0,0,0,1|2,0,0]=4 2234 B15R1.1091 ONC(=O)CCCOc1ccccc1F Amb22039487 [0,1,0,0,0,1|2,0,0]=4 2235 B15R1.1321 CC(CNCc1ccccc1)C(=O)NN Amb25246674 [0,1,0,0,0,1|2,0,0]=4 2236 B15R1.1321 CC(CNCc1ccccc1)C(=O)NO Amb25075668 [0,1,0,0,0,1|2,0,0]=4 2237 B15R1.1321 CCC(=O)C(C)CC#Cc1ccccc1 Amb24413399 [0,1,0,0,0,1|1,0,1]=4 2238 B15R1.1321 CCC(=O)C(C)CNCc1ccccc1 Amb25104862 [0,1,0,0,0,1|1,0,0]=3 2239 B15R1.1321 CCC(=O)C(C)COCc1ccccc1 Amb25307969 [0,1,0,0,0,1|1,0,0]=3 2240 B15R1.1321 CCC(=O)N(C)CCOc1ccccc1 Amb22265725 [0,1,0,0,0,1|2,0,0]=4 2241 B15R1.1321 CN(OC)C(=O)CCCc1ccccc1 Amb20673757 [0,1,0,0,0,1|2,0,0]=4 2242 B15R1.1321 CNC(=O)C(=O)NCCc1ccccc1 Amb1859441 [0,1,0,0,0,1|1,0,1]=4 2243 B15R1.1321 CNC(=O)C(C)NOCc1ccccc1 Amb25671531 [0,1,0,0,0,1|2,0,0]=4 2244 B15R1.1321 CNC(=O)C(N)COCc1ccccc1 Amb25324606 [0,1,0,0,0,1|1,0,0]=3 2245 B15R1.1321 CNC(=O)C(O)COCc1ccccc1 Amb24581273 [0,1,0,0,0,1|1,0,0]=3 2246 B15R1.1321 CNC(=O)[C@@H](N)COCc1ccccc1 Amb25743410 [0,1,0,0,0,1|1,0,0]=3 2247 B15R1.1321 COC(=O)C(Br)CNCc1ccccc1 Amb25282020 [0,1,0,0,0,1|0,0,0]=2 2248 B15R1.1321 COC(=O)C(Cl)CNCc1ccccc1 Amb25781045 [0,1,0,0,0,1|0,0,0]=2 2249 B15R1.1321 COC(=O)C(F)CNCc1ccccc1 Amb24625914 [0,1,0,0,0,1|0,0,0]=2 2250 B15R1.1321 COC(=O)C(N)COCc1ccccc1 Amb24081016 [0,1,0,0,0,1|0,0,0]=2 2251 B15R1.1321 COC(=O)C(O)CNCc1ccccc1 Amb25303504 [0,1,0,0,0,1|0,0,0]=2 2252 B15R1.1321 COC(=O)C(O)COCc1ccccc1 Amb22641879 [0,1,0,0,0,1|0,0,0]=2 2253 B15R1.1321 COC(=O)[C@@H](COCc1ccccc1)O Amb17617212 [0,1,0,0,0,1|0,0,0]=2 2254 B15R1.1321 COC(=O)[C@@H](N)COCc1ccccc1 Amb22746151 [0,1,0,0,0,1|0,0,0]=2 2255 B15R1.1321 COC(=O)[C@@H](N)CSCc1ccccc1 Amb19944285 [0,1,0,0,0,1|0,0,0]=2 2256 B15R1.1321 COC(=O)[C@H](COCc1ccccc1)N Amb10844864 [0,1,0,0,0,1|0,0,0]=2 2257 B15R1.1321 COC(=O)[C@H](CSCc1ccccc1)N Amb16183933 [0,1,0,0,0,1|0,0,0]=2 2258 B15R1.1321 COC(=O)[C@H](N)COCc1ccccc1 Amb25121188 [0,1,0,0,0,1|0,0,0]=2 2259 B15R1.1321 C\C(=C/NCc1ccccc1)\C(=O)OC Amb24680200 [0,1,0,0,0,1|0,0,2]=4 2260 B15R1.1321 OCC(=O)[C@@H](O)CNCc1ccccc1 Amb25800014 [0,1,0,0,0,1|2,0,0]=4 2261 B15R1.3664 CC(=C)C(=O)NCOCc1ccccc1 Amb25270056 [0,1,0,0,0,1|2,0,0]=4 2262 B15R1.3664 CC(=C)C(=O)OCCCc1ccccc1 Amb17934136 [0,1,0,0,0,1|1,0,0]=3 2263 B15R1.3664 CC(=C)C(=O)OCCNc1ccccc1 Amb22456069 [0,1,0,0,0,1|2,0,0]=4 2264 B15R1.3664 CC(=C)C(=O)OCCOc1ccccc1 Amb22352010 [0,1,0,0,0,1|2,0,0]=4 2265 B15R1.3664 CC(C)C(=O)CCC#Cc1ccccc1 Amb19086441 [0,1,0,0,0,1|1,0,1]=4 2266 B15R1.3664 CC(C)C(=O)CCOCc1ccccc1 Amb25241303 [0,1,0,0,0,1|1,0,0]=3 2267 B15R1.3664 CC(C)C(=O)NCCSc1ccccc1 Amb23213963 [0,1,0,0,0,1|2,0,0]=4 2268 B15R1.3664 CC(N)C(=O)CCOCc1ccccc1 Amb24707312 [0,1,0,0,0,1|1,0,0]=3 2269 B15R1.3664 CC(N)C(=O)NCCCc1cccc[n]1 Amb24783189 [0,1,0,0,0,1|2,0,0]=4 2270 B15R1.3664 CC(N)C(=O)NCCOc1ccccc1 Amb24771522 [0,1,0,0,0,1|2,0,0]=4 2271 B15R1.3664 CN(C)C(=O)CCCSc1ccccc1 Amb22285398 [0,1,0,0,0,1|1,0,0]=3 2272 B15R1.3664 CN(C)C(=O)CCNCc1ccccc1 Amb25677355 [0,1,0,0,0,1|1,0,0]=3 2273 B15R1.3664 CN(C)C(=O)CC\C=C\c1ccccc1 Amb24110297 [0,1,0,0,0,1|1,0,1]=4 2274 B15R1.3664 CN(C)C(=O)CNOCc1ccccc1 Amb25372296 [0,1,0,0,0,1|2,0,0]=4 2275 B15R1.3664 CN(C)\C(\N)=N\CCCc1ccccc1 Amb24235171 [0,1,0,0,0,1|2,0,0]=4 2276 B15R1.3664 C[C@@H](N)C(=O)NCCOc1ccccc1 Amb24771525 [0,1,0,0,0,1|2,0,0]=4 2277 B15R1.3664 C[C@@H](N)C(=O)NCCSc1ccccc1 Amb24771459 [0,1,0,0,0,1|2,0,0]=4 2278 B15R1.3664 C[C@H](N)C(=O)NCCOc1ccccc1 Amb24771523 [0,1,0,0,0,1|2,0,0]=4 2279 B15R1.3664 C[C@H](N)C(=O)NCCSc1ccccc1 Amb24770334 [0,1,0,0,0,1|2,0,0]=4 2280 B15R1.3664 O=C(C(C)C)CCCCc1ccccc1 Amb17238167 [0,1,0,0,0,1|1,0,0]=3 2281 B15R1.3664 O=C(C(C)C)CCCCc1cccnc1 Amb17238470 [0,1,0,0,0,1|2,0,0]=4 2282 B15R1.3664 OC(=O)C(=O)NCCCc1ccccc1 Amb18529576 [0,1,0,0,0,1|2,0,0]=4 2283 B15R1.11 BrCCC(=O)NCCc1ccc(cc1)O Amb17333048 [0,2,0,0,0,0|2,0,0]=4 2284 B15R1.11 CCCC(=O)CCCc1ccc(cc1)Br Amb17273848 [0,2,0,0,0,0|1,0,0]=3 2285 B15R1.11 CCCC(=O)CCCc1ccc(cc1)C Amb17238178 [0,2,0,0,0,0|1,0,0]=3 2286 B15R1.11 CCCC(=O)CCCc1ccc(cc1)Cl Amb17246789 [0,2,0,0,0,0|1,0,0]=3 2287 B15R1.11 CCCC(=O)CCCc1ccc(cc1)F Amb17239888 [0,2,0,0,0,0|1,0,0]=3 2288 B15R1.11 CCCC(=O)NCCc1ccc(N)cc1 Amb24770404 [0,2,0,0,0,0|2,0,0]=4 2289 B15R1.11 CCNC(=O)CCOc1ccc(F)cc1 Amb20950316 [0,2,0,0,0,0|2,0,0]=4 2290 B15R1.11 CCNC(=O)CCSc1ccc(F)cc1 Amb22285022 [0,2,0,0,0,0|2,0,0]=4 2291 B15R1.11 CCNC(=O)CCSc1ccc(cc1)C Amb1835165 [0,2,0,0,0,0|2,0,0]=4 2292 B15R1.11 CCNC(=O)CSCc1ccc(Cl)cc1 Amb21618406 [0,2,0,0,0,0|2,0,0]=4 2293 B15R1.11 CCNC(=O)NCCc1ccc(N)cc1 Amb19011036 [0,2,0,0,0,0|2,0,0]=4 2294 B15R1.11 CCNC(=O)NCCc1ccc(cc1)Cl Amb144972 [0,2,0,0,0,0|2,0,0]=4 2295 B15R1.11 CCNC(=O)NCCc1ccc(cc1)O Amb13883052 [0,2,0,0,0,0|2,0,0]=4 2296 B15R1.11 CCOC(=O)CCCc1ccc(Br)cc1 Amb18110225 [0,2,0,0,0,0|0,0,0]=2 2297 B15R1.11 CCOC(=O)CCCc1ccc(Cl)cc1 Amb18110226 [0,2,0,0,0,0|0,0,0]=2 2298 B15R1.11 CCOC(=O)CCCc1ccc(F)cc1 Amb18110227 [0,2,0,0,0,0|0,0,0]=2 2299 B15R1.11 CCOC(=O)CCCc1ccc(N)cc1 Amb20247754 [0,2,0,0,0,0|0,0,0]=2 2300 B15R1.11 CCOC(=O)CCCc1ccc(O)cc1 Amb22491838 [0,2,0,0,0,0|0,0,0]=2 2301 B15R1.11 CCOC(=O)CCNc1ccc(cc1)Br Amb1981436 [0,2,0,0,0,0|1,0,0]=3 2302 B15R1.11 CCOC(=O)CNCc1ccc(cc1)Br Amb17305755 [0,2,0,0,0,0|1,0,0]=3 2303 B15R1.11 CCOC(=O)CNCc1ccc(cc1)C Amb13951238 [0,2,0,0,0,0|1,0,0]=3 2304 B15R1.11 CCOC(=O)CNCc1ccc(cc1)F Amb13951825 [0,2,0,0,0,0|1,0,0]=3 2305 B15R1.11 CCOC(=O)CSCc1ccc(Br)cc1 Amb22285149 [0,2,0,0,0,0|1,0,0]=3 2306 B15R1.11 CCOC(=O)CSCc1ccc(Cl)cc1 Amb17799390 [0,2,0,0,0,0|1,0,0]=3 2307 B15R1.11 CCOC(=O)NCCc1ccc(Cl)cc1 Amb22285178 [0,2,0,0,0,0|1,0,0]=3 2308 B15R1.11 CCOC(=O)NCCc1ccc(cc1)C Amb17602687 [0,2,0,0,0,0|1,0,0]=3 2309 B15R1.11 CCOC(=O)NCCc1ccc(cc1)F Amb17602688 [0,2,0,0,0,0|1,0,0]=3 2310 B15R1.11 CCOC(=O)\C=C\Cc1ccc(Cl)cc1 Amb22169827 [0,2,0,0,0,0|0,0,2]=4 2311 B15R1.11 CNCC(=O)NCCc1ccc(Cl)cc1 Amb25388752 [0,2,0,0,0,0|2,0,0]=4 2312 B15R1.11 CNCC(=O)NCCc1ccc(F)cc1 Amb25388587 [0,2,0,0,0,0|2,0,0]=4 2313 B15R1.11 CNCC(=O)NCCc1ccc(O)cc1 Amb24770495 [0,2,0,0,0,0|2,0,0]=4 2314 B15R1.11 COCC(=O)NCCc1ccc(Cl)cc1 Amb22547654 [0,2,0,0,0,0|1,0,0]=3 2315 B15R1.11 COCC(=O)NCCc1ccc(N)cc1 Amb24770709 [0,2,0,0,0,0|1,0,0]=3 2316 B15R1.11 CONC(=O)CCSc1ccc(cc1)Cl Amb15704832 [0,2,0,0,0,0|1,0,0]=3 2317 B15R1.11 CONC(=O)CSCc1ccc(Cl)cc1 Amb20813813 [0,2,0,0,0,0|1,0,0]=3 2318 B15R1.11 CONC(=O)NCCc1ccc(cc1)F Amb11292081 [0,2,0,0,0,0|1,0,0]=3 2319 B15R1.11 Cc1ccc(CCCC(=O)OCC)cc1 Amb18629310 [0,2,0,0,0,0|0,0,0]=2 2320 B15R1.11 Cc1ccc(CCNC(=O)CNC)cc1 Amb25399316 [0,2,0,0,0,0|2,0,0]=4 2321 B15R1.11 Cc1ccc(CSCC(=O)NOC)cc1 Amb20813812 [0,2,0,0,0,0|1,0,0]=3 2322 B15R1.11 Cc1ccc([n]c1)SCCC(=O)OCC Amb24244786 [0,2,0,0,0,0|2,0,0]=4 2323 B15R1.11 Cc1ccc(cc1)NCCC(=N)OCC Amb24103642 [0,2,0,0,0,0|2,0,0]=4 2324 B15R1.11 ClCCC(=O)NCCc1ccc(cc1)C Amb17329838 [0,2,0,0,0,0|2,0,0]=4 2325 B15R1.11 NCCC(=O)NCCc1ccc(Cl)cc1 Amb24770555 [0,2,0,0,0,0|2,0,0]=4 2326 B15R1.11 NCCC(=O)NCCc1ccc(F)cc1 Amb25388110 [0,2,0,0,0,0|2,0,0]=4 2327 B15R1.11 NCCC(=O)NCCc1ccc(cc1)C Amb17403323 [0,2,0,0,0,0|2,0,0]=4 2328 B15R1.112 CC(C(=O)NCCc1ccc(cc1)Br)N Amb17419745 [0,2,0,0,0,0|2,0,0]=4 2329 B15R1.112 CC(C(=O)NCCc1ccc(cc1)F)Br Amb17324172 [0,2,0,0,0,0|2,0,0]=4 2330 B15R1.112 CC(C(=O)NCCc1ccc(cc1)F)C Amb2178061 [0,2,0,0,0,0|2,0,0]=4 2331 B15R1.112 CC(C(=O)NCCc1ccc(cc1)F)Cl Amb1107388 [0,2,0,0,0,0|2,0,0]=4 2332 B15R1.112 CC(C(=O)NCCc1ccc(cc1)N)C Amb17140116 [0,2,0,0,0,0|2,0,0]=4 2333 B15R1.112 CC(C(=O)NCCc1ccc(cc1)O)Br Amb17324171 [0,2,0,0,0,0|2,0,0]=4 2334 B15R1.112 CC(C(=O)NCCc1ccc(cc1)O)Cl Amb17325051 [0,2,0,0,0,0|2,0,0]=4 2335 B15R1.112 CC(C)C(=O)NCCc1ccc(N)cc1 Amb24770402 [0,2,0,0,0,0|2,0,0]=4 2336 B15R1.112 CC(N)C(=O)NCCc1ccc(Br)cc1 Amb25389960 [0,2,0,0,0,0|2,0,0]=4 2337 B15R1.112 CC(N)C(=O)NCCc1ccc(Cl)cc1 Amb24770562 [0,2,0,0,0,0|2,0,0]=4 2338 B15R1.112 CC(N)C(=O)NCCc1ccc(F)cc1 Amb25388586 [0,2,0,0,0,0|2,0,0]=4 2339 B15R1.112 CC(N)C(=O)NCCc1ccc(O)cc1 Amb24770494 [0,2,0,0,0,0|2,0,0]=4 2340 B15R1.112 CN(C(=O)CCCc1ccc(cc1)N)C Amb17338565 [0,2,0,0,0,0|1,0,0]=3 2341 B15R1.112 CN(C(=O)CCOc1ccc(cc1)Br)C Amb15714341 [0,2,0,0,0,0|2,0,0]=4 2342 B15R1.112 CN(C(=O)CCOc1ccc(cc1)Cl)C Amb10652046 [0,2,0,0,0,0|2,0,0]=4 2343 B15R1.112 CN(C(=O)CCOc1ccc(cc1)N)C Amb13951785 [0,2,0,0,0,0|2,0,0]=4 2344 B15R1.112 CN(C(=O)CCSc1ccc(cc1)F)C Amb15702155 [0,2,0,0,0,0|2,0,0]=4 2345 B15R1.112 CN(C)C(=O)CSCc1ccc(F)cc1 Amb22275797 [0,2,0,0,0,0|2,0,0]=4 2346 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(Cl)cc1 Amb18014714 [0,2,0,0,0,0|2,0,0]=4 2347 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(Cl)cc1 Amb24771348 [0,2,0,0,0,0|2,0,0]=4 2348 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(F)cc1 Amb18014660 [0,2,0,0,0,0|2,0,0]=4 2349 B15R1.112 C[C@@H](N)C(=O)NCCc1ccc(F)cc1 Amb24771383 [0,2,0,0,0,0|2,0,0]=4 2350 B15R1.112 C[C@H](N)C(=O)NCCc1ccc(Cl)cc1 Amb24770570 [0,2,0,0,0,0|2,0,0]=4 2351 B15R1.112 Cc1ccc(CCNC(=O)C(C)N)cc1 Amb25389948 [0,2,0,0,0,0|2,0,0]=4 2352 B15R1.112 Cc1ccc(CCNC(=O)[C@H](C)N)cc1 Amb24773155 [0,2,0,0,0,0|2,0,0]=4 2353 B15R1.112 Cc1ccc(CSCC(=O)N(C)C)cc1 Amb21128703 [0,2,0,0,0,0|2,0,0]=4 2354 B15R1.112 Cc1ccc(cc1)OCCC(=O)N(C)C Amb22268819 [0,2,0,0,0,0|2,0,0]=4 2355 B15R1.112 Cc1ccc(cc1)SCCC(=O)N(C)C Amb1827368 [0,2,0,0,0,0|2,0,0]=4 2356 B15R1.112 O=C(C(Cl)C)NCCc1ccc(cc1)C Amb17331890 [0,2,0,0,0,0|2,0,0]=4 2357 B15R1.112 O=C(C(N)C)NCCc1ccc(cc1)C Amb17403324 [0,2,0,0,0,0|2,0,0]=4 2358 B15R1.132 CCC(=O)NCC(c1ccc(cc1)Br)O Amb17364711 [0,2,0,0,0,0|2,0,0]=4 2359 B15R1.132 CCC(=O)NCC(c1ccc(cc1)C)O Amb17338748 [0,2,0,0,0,0|2,0,0]=4 2360 B15R1.132 CCC(=O)NCC(c1ccc(cc1)Cl)O Amb17343947 [0,2,0,0,0,0|2,0,0]=4 2361 B15R1.132 CCC(=O)NCC(c1ccc(cc1)F)O Amb17339618 [0,2,0,0,0,0|2,0,0]=4 2362 B15R1.132 CNC(=O)CCC(=O)c1ccc(cc1)Br Amb1230588 [0,2,0,0,0,0|1,0,1]=4 2363 B15R1.132 CNC(=O)CCC(=O)c1ccc(cc1)C Amb15823510 [0,2,0,0,0,0|1,0,1]=4 2364 B15R1.132 CNC(=O)CCC(=O)c1ccc(cc1)Cl Amb17343482 [0,2,0,0,0,0|1,0,1]=4 2365 B15R1.132 CNC(=O)CCC(=O)c1ccc(cc1)F Amb17339209 [0,2,0,0,0,0|1,0,1]=4 2366 B15R1.132 CNC(=O)CCC(=O)c1ccc(cc1)N Amb17338507 [0,2,0,0,0,0|1,0,1]=4 2367 B15R1.132 CNC(=O)CCC(c1ccc(cc1)Br)O Amb17364714 [0,2,0,0,0,0|1,0,0]=3 2368 B15R1.132 CNC(=O)CCC(c1ccc(cc1)C)O Amb17338777 [0,2,0,0,0,0|1,0,0]=3 2369 B15R1.132 CNC(=O)CCC(c1ccc(cc1)Cl)O Amb17343952 [0,2,0,0,0,0|1,0,0]=3 2370 B15R1.132 CNC(=O)CCC(c1ccc(cc1)F)O Amb17339622 [0,2,0,0,0,0|1,0,0]=3 2371 B15R1.132 CNC(=O)CSC(C)c1ccc(Br)cc1 Amb22157678 [0,2,0,0,0,0|2,0,0]=4 2372 B15R1.132 COC(=O)CCC(=O)c1c[n]c(O)cc1 Amb21618939 [0,2,0,0,0,0|1,0,1]=4 2373 B15R1.132 COC(=O)CCC(=O)c1ccc(cc1)Cl Amb17343658 [0,2,0,0,0,0|0,0,1]=3 2374 B15R1.132 COC(=O)CCC(O)c1ccc(Br)cc1 Amb18108514 [0,2,0,0,0,0|0,0,0]=2 2375 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)F Amb1212542 [0,2,0,0,0,0|1,0,1]=4 2376 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)N Amb2339872 [0,2,0,0,0,0|1,0,1]=4 2377 B15R1.132 COC(=O)CNC(=O)c1ccc(cc1)N Amb2371210 [0,2,0,0,0,0|1,0,1]=4 2378 B15R1.132 COC(=O)COC(=O)c1ccc(N)cc1 Amb22233278 [0,2,0,0,0,0|1,0,1]=4 2379 B15R1.132 COC(=O)NNC(C)c1ccc(F)cc1 Amb24096224 [0,2,0,0,0,0|2,0,0]=4 2380 B15R1.206 CCC(=O)CCCc1ccc(cc1)CC Amb17238180 [0,2,0,0,0,0|1,0,0]=3 2381 B15R1.206 CCC(=O)CCCc1ccc(cc1)OC Amb17238901 [0,2,0,0,0,0|1,0,0]=3 2382 B15R1.206 CCC(=O)CCOc1ccc(cc1)CC Amb17140088 [0,2,0,0,0,0|2,0,0]=4 2383 B15R1.206 CCC(=O)CCOc1ccc(cc1)OC Amb17140294 [0,2,0,0,0,0|2,0,0]=4 2384 B15R1.206 CCc1ccc(CCCC(=O)OC)cc1 Amb18628143 [0,2,0,0,0,0|0,0,0]=2 2385 B15R1.206 CNC(=O)CCSc1ccc(cc1)OC Amb19423324 [0,2,0,0,0,0|2,0,0]=4 2386 B15R1.206 CNC(=O)NCCc1ccc(cc1)OC Amb2132769 [0,2,0,0,0,0|2,0,0]=4 2387 B15R1.206 COC(=O)C#CCc1ccc(cc1)OC Amb24391862 [0,2,0,0,0,0|0,0,2]=4 2388 B15R1.206 COC(=O)CCNc1ccc(cn1)C#N Amb10697654 [0,2,0,0,0,0|2,0,0]=4 2389 B15R1.206 COc1ccc(CCCC(=O)OC)cc1 Amb18110196 [0,2,0,0,0,0|0,0,0]=2 2390 B15R1.206 COc1ccc(\C=N\CC(=O)OC)cc1 Amb22347632 [0,2,0,0,0,0|1,0,1]=4 2391 B15R1.206 NNC(=O)CCCc1ccc(cc1)OC Amb1822312 [0,2,0,0,0,0|2,0,0]=4 2392 B15R1.206 OCc1ccc(cc1)CCCC(=O)OC Amb16233194 [0,2,0,0,0,0|0,0,0]=2 2393 B15R1.981 CCC(=O)NC(Cc1ccc(cc1)Br)C Amb10652717 [0,2,0,0,0,0|2,0,0]=4 2394 B15R1.981 CNC(=O)CN(C)Cc1ccc(F)cc1 Amb21525579 [0,2,0,0,0,0|2,0,0]=4 2395 B15R1.981 CNC(=O)CN(Cc1ccc(cc1)Cl)C Amb10613388 [0,2,0,0,0,0|2,0,0]=4 2396 B15R1.981 COC(=O)CC(=O)Cc1ccc(Cl)cc1 Amb19943930 [0,2,0,0,0,0|0,0,1]=3 2397 B15R1.981 COC(=O)CC(Br)Cc1ccc(F)cc1 Amb18111049 [0,2,0,0,0,0|0,0,0]=2 2398 B15R1.981 COC(=O)CC(Cl)Cc1ccc(Cl)cc1 Amb18110696 [0,2,0,0,0,0|0,0,0]=2 2399 B15R1.981 COC(=O)CC(Cl)Cc1ccc(F)cc1 Amb18629899 [0,2,0,0,0,0|0,0,0]=2 2400 B15R1.981 COC(=O)CC(N)Cc1ccc(Br)cc1 Amb18629780 [0,2,0,0,0,0|0,0,0]=2 2401 B15R1.981 COC(=O)CC(N)Cc1ccc(Cl)cc1 Amb18628875 [0,2,0,0,0,0|0,0,0]=2 2402 B15R1.981 COC(=O)CC(N)Cc1ccc(F)cc1 Amb18629806 [0,2,0,0,0,0|0,0,0]=2 2403 B15R1.981 COC(=O)CN(C)Cc1ccc(Br)cc1 Amb21536933 [0,2,0,0,0,0|1,0,0]=3 2404 B15R1.981 COC(=O)CN(C)Cc1ccc(Cl)cc1 Amb21536932 [0,2,0,0,0,0|1,0,0]=3 2405 B15R1.981 COC(=O)\C=C(/Cc1ccc(cc1)Cl)\N Amb2420816 [0,2,0,0,0,0|0,0,2]=4 2406 B15R1.981 Cc1ccc(CC(=O)CC(=O)OC)cc1 Amb19943932 [0,2,0,0,0,0|0,0,1]=3 2407 B15R1.981 Cc1ccc(CC(Br)CC(=O)OC)cc1 Amb18629522 [0,2,0,0,0,0|0,0,0]=2 2408 B15R1.981 Cc1ccc(CC(Cl)CC(=O)OC)cc1 Amb18111204 [0,2,0,0,0,0|0,0,0]=2 2409 B15R1.981 Cc1ccc(CC(N)CC(=O)OC)cc1 Amb18629754 [0,2,0,0,0,0|0,0,0]=2 2410 B15R1.1001 CNC(=O)C(SCc1ccc(cc1)Br)C Amb246145 [0,2,0,0,0,0|2,0,0]=4 2411 B15R1.1001 COC(=O)C(C)CNc1ccc(Cl)c[n]1 Amb18095607 [0,2,0,0,0,0|2,0,0]=4 2412 B15R1.1001 COC(=O)C(SCc1ccc(cc1)N)C Amb17497482 [0,2,0,0,0,0|1,0,0]=3 2413 B15R1.1001 Cc1ccc(NCC(C)C(=O)OC)[n]c1 Amb18095568 [0,2,0,0,0,0|2,0,0]=4 2414 B15R1.1001 Cc1ccc(cc1)SCC(O)C(=O)OC Amb22466692 [0,2,0,0,0,0|1,0,0]=3 2415 B15R1.3836 CNC(=O)CSCc1ccc(Cl)cc1F Amb23350373 [0,2,0,0,0,0|2,0,0]=4 2416 B15R1.3836 CNC(=O)CSCc1ccc(F)cc1Br Amb21215691 [0,2,0,0,0,0|2,0,0]=4 2417 B15R1.3836 COC(=O)C#CCc1ccc(F)cc1F Amb25205512 [0,2,0,0,0,0|0,0,2]=4 2418 B15R1.3836 COC(=O)CCCc1ccc(Cl)cc1Cl Amb18629277 [0,2,0,0,0,0|0,0,0]=2 2419 B15R1.3836 COC(=O)CCCc1ccc(Cl)cc1N Amb21864903 [0,2,0,0,0,0|0,0,0]=2 2420 B15R1.3836 COC(=O)CCCc1ccc(Cl)cc1N Amb22450713 [0,2,0,0,0,0|0,0,0]=2 2421 B15R1.3836 Cc1ccc(CCCC(=O)OC)c(C)c1 Amb18629278 [0,2,0,0,0,0|0,0,0]=2 2422 B15R1.3836 Cc1ccc(OCCC(=O)NC)c(C)c1 Amb19429224 [0,2,0,0,0,0|2,0,0]=4 2423 B15R1.11630 CNC(=O)CCCc1ccc(O)c(O)c1 Amb24102783 [0,2,0,0,0,0|1,0,0]=3 2424 B15R1.11630 CNC(=O)CSCc1ccc(Br)c(Cl)c1 Amb24306150 [0,2,0,0,0,0|2,0,0]=4 2425 B15R1.11630 CNC(=O)CSCc1ccc(Br)c(F)c1 Amb22134427 [0,2,0,0,0,0|2,0,0]=4 2426 B15R1.11630 CNC(=O)CSCc1ccc(Cl)c(F)c1 Amb24216484 [0,2,0,0,0,0|2,0,0]=4 2427 B15R1.11630 CNC(=O)CSCc1ccc(F)c(Cl)c1 Amb24283689 [0,2,0,0,0,0|2,0,0]=4 2428 B15R1.11630 COC(=O)C#CCc1ccc(F)c(F)c1 Amb24441268 [0,2,0,0,0,0|0,0,2]=4 2429 B15R1.11630 COC(=O)CCCc1cc(Cl)c(Cl)cc1 Amb18629298 [0,2,0,0,0,0|0,0,0]=2 2430 B15R1.11630 COC(=O)CCCc1cc(F)c(F)cc1 Amb18110213 [0,2,0,0,0,0|0,0,0]=2 2431 B15R1.11630 COC(=O)CNCc1cc(F)c(F)cc1 Amb19339858 [0,2,0,0,0,0|1,0,0]=3 2432 B15R1.11630 COC(=O)CNCc1ccc(c(c1)Cl)Cl Amb2281688 [0,2,0,0,0,0|1,0,0]=3 2433 B15R1.11630 COC(=O)NCCc1cc(Cl)c(Cl)cc1 Amb22453608 [0,2,0,0,0,0|1,0,0]=3 2434 B15R1.11630 COC(=O)NCCc1ccc(F)c(Br)c1 Amb22395017 [0,2,0,0,0,0|1,0,0]=3 2435 B15R1.11630 COC(=O)NCCc1ccc(O)c(O)c1 Amb22453601 [0,2,0,0,0,0|1,0,0]=3 2436 B15R1.11630 Cc1cc(CCCC(=O)OC)ccc1C Amb18108524 [0,2,0,0,0,0|0,0,0]=2 2437 B15R1.11630 Cc1cc(CCCC(=O)OC)ccc1Cl Amb18110194 [0,2,0,0,0,0|0,0,0]=2 2438 B15R1.11630 Cc1cc(CCCC(=O)OC)ccc1F Amb18110204 [0,2,0,0,0,0|0,0,0]=2 2439 B15R1.11630 Cc1cc(CSCC(=O)NC)ccc1Br Amb24276855 [0,2,0,0,0,0|2,0,0]=4 2440 B15R1.11630 Cc1cc(ccc1C)SCCC(=O)NC Amb19338723 [0,2,0,0,0,0|2,0,0]=4 2441 B15R1.11630 Cc1ccc(cc1Br)NCCC(=O)OC Amb18607730 [0,2,0,0,0,0|1,0,0]=3 2442 B15R1.89 BrCCC(=O)NCC(c1ccccc1)O Amb17330748 [0,2,0,0,0,0|2,0,0]=4 2443 B15R1.89 CC(CNC(=O)CCN)c1ccccc1 Amb24770583 [0,2,0,0,0,0|2,0,0]=4 2444 B15R1.89 CCCC(=O)NCC(C)c1ccccc1 Amb22268734 [0,2,0,0,0,0|2,0,0]=4 2445 B15R1.89 CCNC(=O)CCC(=O)c1ccccc1 Amb17338274 [0,2,0,0,0,0|1,0,1]=4 2446 B15R1.89 CCNC(=O)NCC(C)c1ccccc1 Amb21793921 [0,2,0,0,0,0|2,0,0]=4 2447 B15R1.89 CCOC(=O)CCC(Br)c1ccccc1 Amb24089411 [0,2,0,0,0,0|0,0,0]=2 2448 B15R1.89 CCOC(=O)CCC(N)c1ccc[n]c1 Amb24117099 [0,2,0,0,0,0|1,0,0]=3 2449 B15R1.89 CCOC(=O)CCC(c1ccccc1)Cl Amb17217298 [0,2,0,0,0,0|0,0,0]=2 2450 B15R1.89 CCOC(=O)CN[C@@H](C)c1ccccc1 Amb17739848 [0,2,0,0,0,0|1,0,0]=3 2451 B15R1.89 CCOC(=O)CN[C@H](C)c1ccccc1 Amb17935772 [0,2,0,0,0,0|1,0,0]=3 2452 B15R1.89 CCOC(=O)CSC(=O)c1ccccc1 Amb10573023 [0,2,0,0,0,0|1,0,1]=4 2453 B15R1.89 CCOC(=O)NCC(C)c1ccccc1 Amb22285176 [0,2,0,0,0,0|1,0,0]=3 2454 B15R1.89 CNCC(=O)NCC(C)c1ccccc1 Amb25388734 [0,2,0,0,0,0|2,0,0]=4 2455 B15R1.89 COCC(=O)NCC(c1ccccc1)C Amb10612526 [0,2,0,0,0,0|1,0,0]=3 2456 B15R1.89 CONC(=O)CNC(=O)c1ccccc1 Amb21787793 [0,2,0,0,0,0|1,0,1]=4 2457 B15R1.133 CNC(=O)CCC(=O)c1cccc(c1)Br Amb17363513 [0,2,0,0,0,0|1,0,1]=4 2458 B15R1.133 CNC(=O)CCC(=O)c1cccc(c1)N Amb17338506 [0,2,0,0,0,0|1,0,1]=4 2459 B15R1.133 CNC(=O)CCC(c1cccc(c1)Br)O Amb17364715 [0,2,0,0,0,0|1,0,0]=3 2460 B15R1.133 CNC(=O)CCC(c1cccc(c1)N)O Amb17339067 [0,2,0,0,0,0|1,0,0]=3 2461 B15R1.133 COC(=O)CNC(=O)c1cccc(c1)C Amb2417171 [0,2,0,0,0,0|1,0,1]=4 2462 B15R1.133 COC(=O)CNC(=O)c1cccc(c1)N Amb1118736 [0,2,0,0,0,0|1,0,1]=4 2463 B15R1.500 CC(C)C(=O)NCC(C)c1ccccc1 Amb22266101 [0,2,0,0,0,0|2,0,0]=4 2464 B15R1.500 CC(CNC(=O)C(C)N)c1ccccc1 Amb24770584 [0,2,0,0,0,0|2,0,0]=4 2465 B15R1.500 CC(CNC(=O)[C@@H](C)N)c1ccccc1 Amb24771448 [0,2,0,0,0,0|2,0,0]=4 2466 B15R1.500 CC(CNC(=O)[C@H](C)N)c1ccccc1 Amb24770597 [0,2,0,0,0,0|2,0,0]=4 2467 B15R1.500 CC(N)C(=O)NCC(O)c1ccccc1 Amb24771239 [0,2,0,0,0,0|2,0,0]=4 2468 B15R1.500 CC(c1ccccc1)CNC(=O)C(Cl)C Amb2303939 [0,2,0,0,0,0|2,0,0]=4 2469 B15R1.500 CN(C(=O)CCC(=O)c1ccccc1)C Amb17338275 [0,2,0,0,0,0|1,0,1]=4 2470 B15R1.500 C[C@@H](N)C(=O)NCC(O)c1ccccc1 Amb24771407 [0,2,0,0,0,0|2,0,0]=4 2471 B15R1.500 C[C@H](N)C(=O)NCC(O)c1ccccc1 Amb24770256 [0,2,0,0,0,0|2,0,0]=4 2472 B15R1.500 OC(c1ccccc1)CCC(=O)N(C)C Amb17338776 [0,2,0,0,0,0|1,0,0]=3 2473 B15R1.500 OC(c1ccccc1)CNC(=O)C(Br)C Amb17332798 [0,2,0,0,0,0|2,0,0]=4 2474 B15R1.947 CN(CC(C)C(=O)OC)c1cccc[n]1 Amb23611872 [0,2,0,0,0,0|2,0,0]=4 2475 B15R1.947 COC(=O)C(=O)CC(=O)c1ccccc1 Amb1212252 [0,2,0,0,0,0|0,0,2]=4 2476 B15R1.947 COC(=O)[C@@H](C)NC(=O)c1ccccc1 Amb22745201 [0,2,0,0,0,0|1,0,1]=4 2477 B15R1.950 COC(=O)CC(=O)C(c1ccccc1)C Amb13893686 [0,2,0,0,0,0|0,0,1]=3 2478 B15R1.950 COC(=O)CC(=O)N(c1ccccc1)C Amb17403408 [0,2,0,0,0,0|1,0,1]=4 2479 B15R1.950 COC(=O)CC(Br)C(=O)c1ccccc1 Amb18114950 [0,2,0,0,0,0|0,0,1]=3 2480 B15R1.950 COC(=O)CC(N)C(=O)c1ccccc1 Amb18108593 [0,2,0,0,0,0|0,0,1]=3 2481 B15R1.950 COC(=O)NC(C(=O)c1ccccc1)O Amb2458335 [0,2,0,0,0,0|1,0,1]=4 2482 B15R1.1094 CC(C)(C#CC(=O)OC)c1ccccc1 Amb25171196 [0,2,0,0,0,0|0,0,2]=4 2483 B15R1.1094 CC(C)(CCC(=O)OC)c1ccccc1 Amb23570466 [0,2,0,0,0,0|0,0,0]=2 2484 B15R1.1094 COC(=O)CNS(=O)(=O)c1ccccc1 Amb2582841 [0,2,0,0,0,0|2,0,0]=4 2485 B15R1.5815 COC(=O)CCC(=O)c1ccccc1N Amb22057692 [0,2,0,0,0,0|0,0,1]=3 2486 B15R1.5815 COC(=O)CNC(=O)c1ccccc1Br Amb1913651 [0,2,0,0,0,0|1,0,1]=4 2487 B15R1.3091 C[Si](CCCc1ccccc1)(OC)OC Amb19894010 [0,2,0,0,0,0|0,1,1]=4 2488 B15R1.9539 NCCS(=O)(=O)CCCc1ccccc1 Amb17500565 [0,2,0,0,0,0|2,0,0]=4 2489 B15R1.9539 OCCS(=O)(=O)CCCc1ccccc1 Amb17502701 [0,2,0,0,0,0|2,0,0]=4 2490 B15R1.157 C#CCNC(=O)CCSc1ccccc1 Amb21133703 [0,2,0,0,0,0|2,0,0]=4 2491 B15R1.157 C#CCNC(=O)CNCc1ccccc1 Amb25833483 [0,2,0,0,0,0|2,0,0]=4 2492 B15R1.157 C#CCNC(=O)NCCc1ccccc1 Amb10194206 [0,2,0,0,0,0|2,0,0]=4 2493 B15R1.157 C=CCNC(=O)CCNc1ccccc1 Amb15707793 [0,2,0,0,0,0|2,0,0]=4 2494 B15R1.157 C=CCNC(=O)CNCc1ccccc1 Amb20140988 [0,2,0,0,0,0|2,0,0]=4 2495 B15R1.157 C=CCNC(=O)CSCc1ccccc1 Amb19338250 [0,2,0,0,0,0|2,0,0]=4 2496 B15R1.157 CCCNC(=O)CCNc1ccccc1 Amb19342673 [0,2,0,0,0,0|2,0,0]=4 2497 B15R1.157 CCCNC(=O)CCOc1ccccc1 Amb20694760 [0,2,0,0,0,0|2,0,0]=4 2498 B15R1.157 CCCNC(=O)CCSc1ccccc1 Amb1800595 [0,2,0,0,0,0|2,0,0]=4 2499 B15R1.157 CCNCC(=O)NCCc1ccccc1 Amb20141762 [0,2,0,0,0,0|2,0,0]=4 2500 B15R1.157 CCOCC(=O)NOCc1ccccc1 Amb21387974 [0,2,0,0,0,0|2,0,0]=4 2501 B15R1.157 CCONC(=O)COCc1ccccc1 Amb20813706 [0,2,0,0,0,0|1,0,0]=3 2502 B15R1.157 CNCCC(=O)NCCc1ccccc1 Amb24115262 [0,2,0,0,0,0|2,0,0]=4 2503 B15R1.157 CNCCC(=O)NCCc1ccccc1 Amb24771716 [0,2,0,0,0,0|2,0,0]=4 2504 B15R1.157 COCCC(=O)NOCc1ccccc1 Amb24724155 [0,2,0,0,0,0|2,0,0]=4 2505 B15R1.157 COCCN(C)CCCc1ccccc1 Amb19434857 [0,2,0,0,0,0|2,0,0]=4 2506 B15R1.157 ClCCNC(=O)CCOc1ccccc1 Amb17103228 [0,2,0,0,0,0|2,0,0]=4 2507 B15R1.157 N#CCNC(=O)CCSc1ccccc1 Amb19455509 [0,2,0,0,0,0|2,0,0]=4 2508 B15R1.157 NCCCC(=O)NCCc1ccccc1 Amb25388570 [0,2,0,0,0,0|2,0,0]=4 2509 B15R1.157 NCCNC(=O)CCOc1ccccc1 Amb24271687 [0,2,0,0,0,0|2,0,0]=4 2510 B15R1.157 NCCNC(=O)COCc1ccccc1 Amb24770376 [0,2,0,0,0,0|2,0,0]=4 2511 B15R1.157 O=C(CCCCl)OCCc1ccccc1 Amb19960343 [0,2,0,0,0,0|2,0,0]=4 2512 B15R1.157 O=C(CNCc1ccccc1)NCCF Amb24690121 [0,2,0,0,0,0|2,0,0]=4 2513 B15R1.157 OCCCC(=O)NCCc1ccccc1 Amb17239268 [0,2,0,0,0,0|2,0,0]=4 2514 B15R1.157 OCCNC(=O)CNCc1ccccc1 Amb25351476 [0,2,0,0,0,0|2,0,0]=4 2515 B15R1.157 OCCOC(=O)NOCc1ccccc1 Amb25351315 [0,2,0,0,0,0|2,0,0]=4 2516 B15R1.633 BrCCC(=O)NCCc1cccc(c1)C Amb17333179 [0,2,0,0,0,0|2,0,0]=4 2517 B15R1.633 CC#CC(=O)NCCc1cc(Br)ccc1 Amb25784251 [0,2,0,0,0,0|2,0,0]=4 2518 B15R1.633 CCCC(=O)CCCc1cccc(c1)Br Amb17273845 [0,2,0,0,0,0|1,0,0]=3 2519 B15R1.633 CCCC(=O)CCCc1cccc(c1)C Amb17238175 [0,2,0,0,0,0|1,0,0]=3 2520 B15R1.633 CCCC(=O)CCCc1cccc(c1)Cl Amb17246786 [0,2,0,0,0,0|1,0,0]=3 2521 B15R1.633 CCCC(=O)NCCc1cccc(c1)F Amb15703275 [0,2,0,0,0,0|2,0,0]=4 2522 B15R1.633 CCNC(=O)CCOc1cccc(c1)Br Amb17276066 [0,2,0,0,0,0|2,0,0]=4 2523 B15R1.633 CCNC(=O)CCOc1cccc(c1)C Amb2295061 [0,2,0,0,0,0|2,0,0]=4 2524 B15R1.633 CCNC(=O)CSCc1cccc(Cl)c1 Amb22275794 [0,2,0,0,0,0|2,0,0]=4 2525 B15R1.633 CCNC(=O)NCCc1cc(F)ccc1 Amb20839017 [0,2,0,0,0,0|2,0,0]=4 2526 B15R1.633 CCNC(=O)NCCc1cccc(c1)Cl Amb11266330 [0,2,0,0,0,0|2,0,0]=4 2527 B15R1.633 CCOC(=O)CCCc1cccc(c1)O Amb15692061 [0,2,0,0,0,0|0,0,0]=2 2528 B15R1.633 CCOC(=O)CCNc1cccc(O)c1 Amb18607736 [0,2,0,0,0,0|1,0,0]=3 2529 B15R1.633 CCOC(=O)CCOc1cc(Cl)cc[n]1 Amb22301621 [0,2,0,0,0,0|2,0,0]=4 2530 B15R1.633 CCOC(=O)CCSc1cc(Cl)cc[n]1 Amb22301624 [0,2,0,0,0,0|2,0,0]=4 2531 B15R1.633 CCOC(=O)CNCc1cccc(c1)C Amb17305756 [0,2,0,0,0,0|1,0,0]=3 2532 B15R1.633 CCOC(=O)CNCc1cccc(c1)Cl Amb17305757 [0,2,0,0,0,0|1,0,0]=3 2533 B15R1.633 CCOC(=O)CSCc1cccc(Cl)c1 Amb17760103 [0,2,0,0,0,0|1,0,0]=3 2534 B15R1.633 CNCC(=O)NCCc1cc(Cl)ccc1 Amb24770608 [0,2,0,0,0,0|2,0,0]=4 2535 B15R1.633 CNCC(=O)NCCc1cc(O)ccc1 Amb25399428 [0,2,0,0,0,0|2,0,0]=4 2536 B15R1.633 COCC(=O)NCCc1cccc(c1)Cl Amb10613684 [0,2,0,0,0,0|1,0,0]=3 2537 B15R1.633 COCC(=O)NCCc1cccc(c1)F Amb10616409 [0,2,0,0,0,0|1,0,0]=3 2538 B15R1.633 CONC(=O)CCOc1cccc(c1)Cl Amb15711790 [0,2,0,0,0,0|1,0,0]=3 2539 B15R1.633 CONC(=O)CSCc1cccc(Cl)c1 Amb20813810 [0,2,0,0,0,0|1,0,0]=3 2540 B15R1.633 CONC(=O)NCCc1cc(Cl)ccc1 Amb21259903 [0,2,0,0,0,0|1,0,0]=3 2541 B15R1.633 CONC(=O)NCCc1cccc(c1)F Amb11298390 [0,2,0,0,0,0|1,0,0]=3 2542 B15R1.633 CSCC(=O)NCCc1cccc(Cl)c1 Amb20702905 [0,2,0,0,0,0|1,1,0]=4 2543 B15R1.633 Cc1cc(CCNC(=O)CCN)ccc1 Amb24772685 [0,2,0,0,0,0|2,0,0]=4 2544 B15R1.633 Cc1cc(CCNC(=O)CNC)ccc1 Amb24772705 [0,2,0,0,0,0|2,0,0]=4 2545 B15R1.633 Cc1cc(CSCC(=O)NCC)ccc1 Amb22265712 [0,2,0,0,0,0|2,0,0]=4 2546 B15R1.633 Cc1cc(CSCC(=O)NOC)ccc1 Amb20892811 [0,2,0,0,0,0|1,0,0]=3 2547 B15R1.633 Cc1cc(ccc1)NCCC(=N)OCC Amb24103640 [0,2,0,0,0,0|2,0,0]=4 2548 B15R1.633 NCCC(=O)NCCc1cccc(Cl)c1 Amb24770593 [0,2,0,0,0,0|2,0,0]=4 2549 B15R1.633 NCCC(=O)NCCc1cccc(c1)C Amb17403319 [0,2,0,0,0,0|2,0,0]=4 2550 B15R1.809 BrCCC(=O)NC(Cc1ccccc1)C Amb17327276 [0,2,0,0,0,0|2,0,0]=4 2551 B15R1.809 CCNC(=O)CN(C)Cc1ccccc1 Amb19967623 [0,2,0,0,0,0|2,0,0]=4 2552 B15R1.809 CCOC(=O)CC(=N)Oc1ccccc1 Amb20247941 [0,2,0,0,0,0|1,0,1]=4 2553 B15R1.809 CCOC(=O)CC(=O)Cc1ccccc1 Amb16231502 [0,2,0,0,0,0|0,0,1]=3 2554 B15R1.809 CCOC(=O)CC(=O)Nc1ccccc1 Amb2051237 [0,2,0,0,0,0|1,0,1]=4 2555 B15R1.809 CCOC(=O)CC(Br)Cc1ccccc1 Amb18111253 [0,2,0,0,0,0|0,0,0]=2 2556 B15R1.809 CCOC(=O)CC(Cl)Cc1ccccc1 Amb18111252 [0,2,0,0,0,0|0,0,0]=2 2557 B15R1.809 CONC(=O)CN(C)Cc1ccccc1 Amb20897986 [0,2,0,0,0,0|1,0,0]=3 2558 B15R1.826 CCCC(=O)N(CCc1ccccc1)C Amb14001758 [0,2,0,0,0,0|2,0,0]=4 2559 B15R1.826 CCNC(=O)C(SCc1ccccc1)C Amb10769154 [0,2,0,0,0,0|2,0,0]=4 2560 B15R1.826 CCOC(=O)C(=O)CCc1c[n]ccc1 Amb24066472 [0,2,0,0,0,0|1,0,1]=4 2561 B15R1.826 CCOC(=O)C(=O)CCc1ccccc1 Amb1233213 [0,2,0,0,0,0|0,0,1]=3 2562 B15R1.826 CCOC(=O)C(=O)NCc1ccccc1 Amb2221403 [0,2,0,0,0,0|1,0,1]=4 2563 B15R1.826 CCOC(=O)C(Cl)CCc1ccccc1 Amb20621212 [0,2,0,0,0,0|0,0,0]=2 2564 B15R1.826 CCOC(=O)C(F)NCc1ccccc1 Amb24657371 [0,2,0,0,0,0|1,0,0]=3 2565 B15R1.826 CCOC(=O)C(N)CCc1ccccc1 Amb22552542 [0,2,0,0,0,0|0,0,0]=2 2566 B15R1.826 CCOC(=O)C(O)CCc1ccccc1 Amb20621230 [0,2,0,0,0,0|0,0,0]=2 2567 B15R1.826 CCOC(=O)C(\N=C\c1ccccc1)C Amb17609055 [0,2,0,0,0,0|1,0,1]=4 2568 B15R1.826 CCOC(=O)N(CCc1ccncc1)C Amb16902406 [0,2,0,0,0,0|2,0,0]=4 2569 B15R1.826 CCOC(=O)[C@@H](C)OCc1ccccc1 Amb19132242 [0,2,0,0,0,0|1,0,0]=3 2570 B15R1.826 CCOC(=O)[C@@H](CCc1ccccc1)N Amb15690587 [0,2,0,0,0,0|0,0,0]=2 2571 B15R1.826 CCOC(=O)[C@@H](OCc1ccccc1)C Amb17613955 [0,2,0,0,0,0|1,0,0]=3 2572 B15R1.826 CCOC(=O)[C@H](C)NCc1ccccc1 Amb25131194 [0,2,0,0,0,0|1,0,0]=3 2573 B15R1.826 COCC(=O)N(CCc1ccncc1)C Amb16900818 [0,2,0,0,0,0|2,0,0]=4 2574 B15R1.826 CONC(=O)C(C)OCc1ccccc1 Amb24570387 [0,2,0,0,0,0|1,0,0]=3 2575 B15R1.826 NCCC(=O)N(CCc1ccccc1)C Amb17239058 [0,2,0,0,0,0|2,0,0]=4 2576 B15R1.1252 CCCC(=O)CCCc1ccccc1C Amb17238171 [0,2,0,0,0,0|1,0,0]=3 2577 B15R1.1252 CCCC(=O)CCCc1ccccc1Cl Amb17246782 [0,2,0,0,0,0|1,0,0]=3 2578 B15R1.1252 CCCC(=O)CCCc1ccccc1F Amb17239885 [0,2,0,0,0,0|1,0,0]=3 2579 B15R1.1252 CCCC(=O)NCCc1ccccc1Br Amb13133627 [0,2,0,0,0,0|2,0,0]=4 2580 B15R1.1252 CCCC(=O)NCCc1ccccc1C Amb15702541 [0,2,0,0,0,0|2,0,0]=4 2581 B15R1.1252 CCCC(=O)NCCc1ccccc1F Amb20702560 [0,2,0,0,0,0|2,0,0]=4 2582 B15R1.1252 CCNC(=O)CCOc1ccccc1F Amb21128813 [0,2,0,0,0,0|2,0,0]=4 2583 B15R1.1252 CCNC(=O)CCSc1ccccc1F Amb21757120 [0,2,0,0,0,0|2,0,0]=4 2584 B15R1.1252 CCNC(=O)NCCc1ccccc1Br Amb13047255 [0,2,0,0,0,0|2,0,0]=4 2585 B15R1.1252 CCNC(=O)NCCc1ccccc1F Amb19420113 [0,2,0,0,0,0|2,0,0]=4 2586 B15R1.1252 CCOC(=N)CCCc1ccccc1Cl Amb24094320 [0,2,0,0,0,0|1,0,0]=3 2587 B15R1.1252 CCOC(=O)CCCc1ccccc1O Amb15692062 [0,2,0,0,0,0|0,0,0]=2 2588 B15R1.1252 CCOC(=O)NOCc1ccccc1Cl Amb22347745 [0,2,0,0,0,0|2,0,0]=4 2589 B15R1.1252 CNCC(=O)NCCc1ccccc1Cl Amb25399429 [0,2,0,0,0,0|2,0,0]=4 2590 B15R1.1252 CNCC(=O)NCCc1ccccc1F Amb25388598 [0,2,0,0,0,0|2,0,0]=4 2591 B15R1.1252 COCC(=O)NCCc1ccccc1C Amb13961523 [0,2,0,0,0,0|1,0,0]=3 2592 B15R1.1252 COCC(=O)NCCc1ccccc1F Amb10613665 [0,2,0,0,0,0|1,0,0]=3 2593 B15R1.1252 CONC(=O)NCCc1ccccc1F Amb11298291 [0,2,0,0,0,0|1,0,0]=3 2594 B15R1.1252 CSCC(=O)NCCc1ccccc1F Amb20702389 [0,2,0,0,0,0|1,1,0]=4 2595 B15R1.1252 Cc1ccccc1NCCC(=N)OCC Amb24103639 [0,2,0,0,0,0|2,0,0]=4 2596 B15R1.1252 Cc1ccccc1OCCC(=O)NCC Amb22285020 [0,2,0,0,0,0|2,0,0]=4 2597 B15R1.1252 NCCC(=O)NCCc1ccccc1C Amb17403316 [0,2,0,0,0,0|2,0,0]=4 2598 B15R1.1252 NCCC(=O)NCCc1ccccc1Cl Amb17406913 [0,2,0,0,0,0|2,0,0]=4 2599 B15R1.1252 NCCC(=O)NCCc1ccccc1F Amb25388113 [0,2,0,0,0,0|2,0,0]=4 2600 B15R1.1306 CO\C(\CNCc1ccccc1)=N\C#N Amb24757234 [0,2,0,0,0,0|2,0,0]=4 2601 B15R1.9084 CC(C)NC(=O)CCOc1ccccc1 Amb20692417 [0,2,0,0,0,0|2,0,0]=4 2602 B15R1.9084 CC(C)NC(=O)NCCc1ccccc1 Amb21196005 [0,2,0,0,0,0|2,0,0]=4 2603 B15R1.9084 CC(C)OC(=O)CCSc1ccccc1 Amb22266204 [0,2,0,0,0,0|1,0,0]=3 2604 B15R1.9084 CC(C)OC(=O)COCc1ccccc1 Amb25120186 [0,2,0,0,0,0|1,0,0]=3 2605 B15R1.9084 CN(C)CC(=O)NCCc1ccccc1 Amb17827032 [0,2,0,0,0,0|2,0,0]=4 2606 B15R1.9084 O=C(C=C(C)C)NCCc1ccccc1 Amb2560676 [0,2,0,0,0,0|2,0,0]=4 2607 B15R1.9084 O=C(CC(=O)C)NCCc1ccccc1 Amb1871453 [0,2,0,0,0,0|2,0,0]=4 2608 B15R1.3010 C\C=C(/COCc1ccccc1)\C(O)=O Amb25224362 [0,2,0,0,0,0|2,0,0]=4 2609 B15R1.762 CNC(=O)CN(C)Cc1ccccc1F Amb21132168 [0,2,0,0,0,0|2,0,0]=4 2610 B15R1.762 COC(=O)CC(=O)Cc1ccccc1Cl Amb19943934 [0,2,0,0,0,0|0,0,1]=3 2611 B15R1.762 COC(=O)CC(=O)Nc1ccccc1Br Amb17420066 [0,2,0,0,0,0|1,0,1]=4 2612 B15R1.762 COC(=O)CC(=O)Nc1ccccc1C Amb17403407 [0,2,0,0,0,0|1,0,1]=4 2613 B15R1.762 COC(=O)CN(C)Cc1ccccc1Br Amb19339422 [0,2,0,0,0,0|1,0,0]=3 2614 B15R1.762 COC(=O)CN(C)Cc1ccccc1Cl Amb21536934 [0,2,0,0,0,0|1,0,0]=3 2615 B15R1.762 COC(=O)CN(C)Cc1ccccc1F Amb21536931 [0,2,0,0,0,0|1,0,0]=3 2616 B15R1.762 Cc1ccccc1CN(C)CC(=O)OC Amb21536959 [0,2,0,0,0,0|1,0,0]=3 2617 B15R1.966 CCN(Cc1ccccc1)CC(=O)NC Amb21156843 [0,2,0,0,0,0|2,0,0]=4 2618 B15R1.966 CNC(Cc1ccccc1)CC(=O)OC Amb18629741 [0,2,0,0,0,0|0,0,0]=2 2619 B15R1.966 COC(=O)CN(Cc1ccccc1)C=O Amb19958569 [0,2,0,0,0,0|1,0,0]=3 2620 B15R1.966 COC(=O)N[C@@H](CO)Cc1ccccc1 Amb22745711 [0,2,0,0,0,0|1,0,0]=3 2621 B15R1.973 CCC(=O)C(C)N(C)Cc1ccccc1 Amb25171098 [0,2,0,0,0,0|2,0,0]=4 2622 B15R1.973 CN(Cc1cc[n]cc1)C(C)C(=O)OC Amb24271725 [0,2,0,0,0,0|2,0,0]=4 2623 B15R1.973 CN(Cc1ccccc1)C(C)C(=O)OC Amb19340558 [0,2,0,0,0,0|1,0,0]=3 2624 B15R1.973 COC(=O)C(=O)N(C)Cc1ccccc1 Amb25857142 [0,2,0,0,0,0|1,0,1]=4 2625 B15R1.973 COC(=O)C(C)C(=O)Cc1ccccc1 Amb20668885 [0,2,0,0,0,0|0,0,1]=3 2626 B15R1.973 COC(=O)[C@@H](N(Cc1ccccc1)C)C Amb16182999 [0,2,0,0,0,0|1,0,0]=3 2627 B15R1.973 COC(=O)[C@H](N(Cc1ccccc1)C)C Amb16182995 [0,2,0,0,0,0|1,0,0]=3 2628 B15R1.982 COC(=O)CC(=O)Cc1cccc(Br)c1 Amb19887581 [0,2,0,0,0,0|0,0,1]=3 2629 B15R1.982 COC(=O)CC(=O)Cc1cccc(Cl)c1 Amb19943933 [0,2,0,0,0,0|0,0,1]=3 2630 B15R1.982 COC(=O)CC(=O)Cc1cccc(I)c1 Amb19887711 [0,2,0,0,0,0|0,0,1]=3 2631 B15R1.982 COC(=O)CC(=O)Nc1cccc(c1)Br Amb17420067 [0,2,0,0,0,0|1,0,1]=4 2632 B15R1.982 COC(=O)CC(=O)Nc1cccc(c1)F Amb17404067 [0,2,0,0,0,0|1,0,1]=4 2633 B15R1.982 COC(=O)CN(C)Cc1cccc(Cl)c1 Amb21536929 [0,2,0,0,0,0|1,0,0]=3 2634 B15R1.982 Cc1cccc(CC(=O)CC(=O)OC)c1 Amb19943931 [0,2,0,0,0,0|0,0,1]=3 2635 B15R1.3675 CC(Cc1ccccc1)NC(=O)C(C)N Amb19036467 [0,2,0,0,0,0|2,0,0]=4 2636 B15R1.3675 CN(C)C(=O)CN(C)Cc1ccccc1 Amb19967694 [0,2,0,0,0,0|2,0,0]=4 2637 B15R1.11663 CCC(=O)NC(Cc1ccccc1)(C)C Amb16787797 [0,2,0,0,0,0|2,0,0]=4 2638 B15R1.11663 CCC(=O)OC(C)(C)Cc1ccccc1 Amb22735011 [0,2,0,0,0,0|2,0,0]=4 2639 B15R1.11663 COC(=O)NC(Cc1ccccc1)(C)C Amb16787838 [0,2,0,0,0,0|1,0,0]=3 2640 B15R1.1002 CNC(=O)C(C)SCc1cccc(Cl)c1 Amb19445025 [0,2,0,0,0,0|2,0,0]=4 2641 B15R1.1002 COC(=O)C(C)CNc1cccc(O)c1 Amb18607737 [0,2,0,0,0,0|1,0,0]=3 2642 B15R1.1002 COC(=O)[C@@H](C)NCc1c[n]cc(Br)c1 Amb24186733 [0,2,0,0,0,0|2,0,0]=4 2643 B15R1.1002 COC(=O)[C@@H](C)NCc1cccc(O)c1 Amb24186666 [0,2,0,0,0,0|1,0,0]=3 2644 B15R1.1002 Cc1cc[n]c(c1)NCC(C)C(=O)OC Amb18095603 [0,2,0,0,0,0|2,0,0]=4 2645 B15R1.1323 COC(=O)C(C)CNc1ccc[n]c1Cl Amb18095605 [0,2,0,0,0,0|2,0,0]=4 2646 B15R1.1323 Cc1ccc[n]c1NCC(C)C(=O)OC Amb18095608 [0,2,0,0,0,0|2,0,0]=4 2647 B15R1.1370 CC[C@@H](NCc1ccccc1)C(=O)OC Amb24539331 [0,2,0,0,0,0|1,0,0]=3 2648 B15R1.1370 CC[C@H](NCc1ccccc1)C(=O)OC Amb25366257 [0,2,0,0,0,0|1,0,0]=3 2649 B15R1.1370 COC(=O)C(C#N)NCc1ccccc1 Amb25775502 [0,2,0,0,0,0|1,0,0]=3 2650 B15R1.1370 COC(=O)C(C=C)NCc1ccccc1 Amb24729310 [0,2,0,0,0,0|1,0,0]=3 2651 B15R1.1370 COC(=O)C(C=C)OCc1ccccc1 Amb25030648 [0,2,0,0,0,0|1,0,0]=3 2652 B15R1.1370 COC(=O)C(CN)OCc1ccccc1 Amb24717548 [0,2,0,0,0,0|1,0,0]=3 2653 B15R1.1370 COC(=O)C(CO)NCc1ccccc1 Amb19958334 [0,2,0,0,0,0|1,0,0]=3 2654 B15R1.1370 COC(=O)C(CS)NCc1ccccc1 Amb25302306 [0,2,0,0,0,0|1,0,0]=3 2655 B15R1.1370 COC(=O)[C@@H](CO)NCc1ccccc1 Amb17739824 [0,2,0,0,0,0|1,0,0]=3 2656 B15R1.1370 COC(=O)[C@@H](CO)NCc1ccccc1 Amb22748800 [0,2,0,0,0,0|1,0,0]=3 2657 B15R1.1370 COC(=O)[C@H](CS)NCc1ccccc1 Amb25326731 [0,2,0,0,0,0|1,0,0]=3 2658 B15R1.1370 OC[C@@H](C(=O)OC)NCc1ccccc1 Amb17609325 [0,2,0,0,0,0|1,0,0]=3 2659 B15R1.1420 CCC(=O)C(C)(C)NCc1ccccc1 Amb18655164 [0,2,0,0,0,0|2,0,0]=4 2660 B15R1.1420 COC(=O)C(C)(N)COc1ccccc1 Amb19350979 [0,2,0,0,0,0|1,0,0]=3 2661 B15R1.1420 COC(=O)C(C)(N)COc1ccccc1 Amb22059041 [0,2,0,0,0,0|1,0,0]=3 2662 B15R1.3678 CC(C)C(=O)[C@H](C)NCc1ccccc1 Amb25227862 [0,2,0,0,0,0|2,0,0]=4 2663 B15R1.3678 CN(C)C(=O)C(C)OCc1ccccc1 Amb24689633 [0,2,0,0,0,0|2,0,0]=4 2664 B15R1.3678 CN(C)C(=O)[C@@H](C)NCc1ccccc1 Amb24363997 [0,2,0,0,0,0|2,0,0]=4 2665 B15R1.3678 CN(C)C(=O)[C@H](C)NCc1ccccc1 Amb25707355 [0,2,0,0,0,0|2,0,0]=4 2666 B15R1.3678 C[C@@H](N)C(=O)N(C)CCc1ccccc1 Amb24771399 [0,2,0,0,0,0|2,0,0]=4 2667 B15R1.3678 O=C(N(CCc1ccccc1)C)C(N)C Amb17403315 [0,2,0,0,0,0|2,0,0]=4 2668 B15R1.85 CCC(=O)CCCc1ccccc1OC Amb17238895 [0,2,0,0,0,0|1,0,0]=3 2669 B15R1.85 CCC(=O)CCOc1ccccc1CC Amb17140086 [0,2,0,0,0,0|2,0,0]=4 2670 B15R1.85 CCC(=O)CCOc1ccccc1OC Amb17140292 [0,2,0,0,0,0|2,0,0]=4 2671 B15R1.85 COC(=O)CCNc1[n]cccc1C#N Amb24058743 [0,2,0,0,0,0|2,0,0]=4 2672 B15R1.85 COC(=O)NCCc1ccccc1OC Amb2134776 [0,2,0,0,0,0|1,0,0]=3 2673 B15R1.85 COc1ccccc1CCCC(=O)OC Amb18895907 [0,2,0,0,0,0|0,0,0]=2 2674 B15R1.85 COc1ccccc1OCCC(=O)NC Amb21128729 [0,2,0,0,0,0|2,0,0]=4 2675 B15R1.257 CC(N)C(=O)NCCc1ccccc1Cl Amb25389689 [0,2,0,0,0,0|2,0,0]=4 2676 B15R1.257 CC(N)C(=O)NCCc1ccccc1F Amb25388597 [0,2,0,0,0,0|2,0,0]=4 2677 B15R1.257 C[C@@H](N)C(=O)NCCc1ccccc1F Amb18014659 [0,2,0,0,0,0|2,0,0]=4 2678 B15R1.257 C[C@@H](N)C(=O)NCCc1ccccc1F Amb24771478 [0,2,0,0,0,0|2,0,0]=4 2679 B15R1.257 C[C@H](N)C(=O)NCCc1ccccc1F Amb24770129 [0,2,0,0,0,0|2,0,0]=4 2680 B15R1.257 O=C(C(C)C)NCCc1ccccc1Br Amb13133616 [0,2,0,0,0,0|2,0,0]=4 2681 B15R1.257 O=C(C(C)C)NCCc1ccccc1C Amb10613670 [0,2,0,0,0,0|2,0,0]=4 2682 B15R1.257 O=C(C(Cl)C)NCCc1ccccc1C Amb13951110 [0,2,0,0,0,0|2,0,0]=4 2683 B15R1.257 O=C(C(N)C)NCCc1ccccc1C Amb17403317 [0,2,0,0,0,0|2,0,0]=4 2684 B15R1.257 O=C(C(N)C)NCCc1ccccc1Cl Amb17406914 [0,2,0,0,0,0|2,0,0]=4 2685 B15R1.257 O=C(N(C)C)CCOc1ccccc1Br Amb17276065 [0,2,0,0,0,0|2,0,0]=4 2686 B15R1.257 O=C(N(C)C)CCOc1ccccc1N Amb17239837 [0,2,0,0,0,0|2,0,0]=4 2687 B15R1.257 O=C(N(C)C)CCSc1ccccc1Br Amb15713068 [0,2,0,0,0,0|2,0,0]=4 2688 B15R1.257 O=C(N(C)C)CCSc1ccccc1F Amb15704173 [0,2,0,0,0,0|2,0,0]=4 2689 B15R1.1368 CNC(=O)CSCc1cccc(F)c1F Amb21171860 [0,2,0,0,0,0|2,0,0]=4 2690 B15R1.1368 Cc1c(CSCC(=O)NC)cccc1Br Amb24222786 [0,2,0,0,0,0|2,0,0]=4 2691 B15R1.1368 Cc1cccc(OCCC(=O)NC)c1C Amb19429401 [0,2,0,0,0,0|2,0,0]=4 2692 B15R1.3175 CCC(=O)NCCc1cc(Br)ccc1F Amb12798162 [0,2,0,0,0,0|2,0,0]=4 2693 B15R1.3175 CNC(=O)NCCc1cc(Br)ccc1F Amb11579069 [0,2,0,0,0,0|2,0,0]=4 2694 B15R1.3175 COC(=O)CCCc1cc(Cl)ccc1O Amb18628198 [0,2,0,0,0,0|0,0,0]=2 2695 B15R1.3175 COC(=O)CCCc1cc(F)ccc1F Amb18110212 [0,2,0,0,0,0|0,0,0]=2 2696 B15R1.3175 COC(=O)CCSC1=CC(=O)C=CC1=O Amb10569137 [0,2,0,0,0,0|1,0,0]=3 2697 B15R1.3175 COC(=O)CCSc1cc(O)ccc1O Amb10568575 [0,2,0,0,0,0|1,0,0]=3 2698 B15R1.3175 Cc1cc(CCCC(=O)OC)c(C)cc1 Amb18110215 [0,2,0,0,0,0|0,0,0]=2 2699 B15R1.3175 Cc1cc(CSCC(=O)NC)c(C)cc1 Amb21620717 [0,2,0,0,0,0|2,0,0]=4 2700 B15R1.42427 COC(=O)C#CCc1c(F)cccc1Cl Amb25139287 [0,2,0,0,0,0|0,0,2]=4 2701 B15R1.42427 COC(=O)C#CCc1c(F)cccc1F Amb24712180 [0,2,0,0,0,0|0,0,2]=4 2702 B15R1.42427 COC(=O)CCCc1c(N)cccc1Cl Amb22462231 [0,2,0,0,0,0|0,0,0]=2 2703 B15R1.121 Brc1cccc(c1)OCCC(=O)N(C)C Amb17276067 [0,2,0,0,0,0|2,0,0]=4 2704 B15R1.121 CC(N)C(=O)NCCc1cccc(Cl)c1 Amb24770607 [0,2,0,0,0,0|2,0,0]=4 2705 B15R1.121 CC(N)C(=O)NCCc1cccc(O)c1 Amb24783829 [0,2,0,0,0,0|2,0,0]=4 2706 B15R1.121 CN(C)C(=O)COCc1cccc(N)c1 Amb23569206 [0,2,0,0,0,0|2,0,0]=4 2707 B15R1.121 C[C@@H](N)C(=O)NCCc1cccc(Cl)c1 Amb18527983 [0,2,0,0,0,0|2,0,0]=4 2708 B15R1.121 C[C@@H](N)C(=O)NCCc1cccc(Cl)c1 Amb24771472 [0,2,0,0,0,0|2,0,0]=4 2709 B15R1.121 C[C@@H](N)C(=O)NCCc1cccc(F)c1 Amb24771485 [0,2,0,0,0,0|2,0,0]=4 2710 B15R1.121 C[C@H](N)C(=O)NCCc1cccc(Cl)c1 Amb24770609 [0,2,0,0,0,0|2,0,0]=4 2711 B15R1.121 C[C@H](N)C(=O)NCCc1cccc(F)c1 Amb24770270 [0,2,0,0,0,0|2,0,0]=4 2712 B15R1.121 Cc1cc(CCNC(=O)C(C)N)ccc1 Amb24772693 [0,2,0,0,0,0|2,0,0]=4 2713 B15R1.121 Cc1cc(CCNC(=O)[C@@H](C)N)ccc1 Amb24772694 [0,2,0,0,0,0|2,0,0]=4 2714 B15R1.121 Cc1cc(CCNC(=O)[C@H](C)N)ccc1 Amb24772692 [0,2,0,0,0,0|2,0,0]=4 2715 B15R1.121 Cc1cccc(c1)CSCC(=O)N(C)C Amb10612316 [0,2,0,0,0,0|2,0,0]=4 2716 B15R1.121 Clc1cccc(c1)CSCC(=O)N(C)C Amb10612317 [0,2,0,0,0,0|2,0,0]=4 2717 B15R1.121 Clc1cccc(c1)OCCC(=O)N(C)C Amb15712015 [0,2,0,0,0,0|2,0,0]=4 2718 B15R1.121 Nc1cccc(c1)CCCC(=O)N(C)C Amb17338567 [0,2,0,0,0,0|1,0,0]=3 2719 B15R1.121 Nc1cccc(c1)OCCC(=O)N(C)C Amb17239839 [0,2,0,0,0,0|2,0,0]=4 2720 B15R1.121 O=C(C(Br)C)NCCc1cccc(c1)C Amb17324301 [0,2,0,0,0,0|2,0,0]=4 2721 B15R1.121 O=C(C(C)C)NCCc1cccc(c1)F Amb10615884 [0,2,0,0,0,0|2,0,0]=4 2722 B15R1.121 O=C(C(N)C)NCCc1cccc(c1)Br Amb17419741 [0,2,0,0,0,0|2,0,0]=4 2723 B15R1.121 O=C(C(N)C)NCCc1cccc(c1)C Amb17403320 [0,2,0,0,0,0|2,0,0]=4 2724 B15R1.931 CNC(=O)CSCc1cc(F)cc(Br)c1 Amb22134471 [0,2,0,0,0,0|2,0,0]=4 2725 B15R1.931 COC(=O)NCCc1cc(F)cc(F)c1 Amb22395014 [0,2,0,0,0,0|1,0,0]=3 2726 B15R1.1569 CCC(=O)CCCc1cccc(c1)OC Amb17238899 [0,2,0,0,0,0|1,0,0]=3 2727 B15R1.1569 CCC(=O)CCOc1cccc(c1)CC Amb17140087 [0,2,0,0,0,0|2,0,0]=4 2728 B15R1.1569 CCC(=O)CCOc1cccc(c1)OC Amb17140293 [0,2,0,0,0,0|2,0,0]=4 2729 B15R1.1569 COC(=O)C#CCc1cc(ccc1)OC Amb25136458 [0,2,0,0,0,0|0,0,2]=4 2730 B15R1.1569 COC(=O)CCCc1cccc(c1)CO Amb16233193 [0,2,0,0,0,0|0,0,0]=2 2731 B15R1.9095 O=C(C(N)(C)C)NCCc1ccccc1 Amb17078311 [0,2,0,0,0,0|2,0,0]=4 2732 B13R1.16 CC=1C(=O)CCCC1C=C\C=C\C Amb24553669 [0,0,1,1,0,0|1,0,1]=4 2733 B13R1.16 CC=1C(=O)CCCC1\C=C\C=C\C Amb24492650 [0,0,1,1,0,0|1,0,1]=4 2734 B13R2.1 CCNC1CCc2c1cccc2 Amb10610131 [1,0,0,1,0,0|2,0,0]=4 2735 B13R2.1 CNCC1CCc2c1cccc2 Amb17470428 [1,0,0,1,0,0|1,0,1]=4 2736 B13R2.1 CONC1CCc2ccc[n]c21 Amb24582671 [1,0,0,1,0,0|2,0,0]=4 2737 B13R2.1 CONC1CSc2ccccc21 Amb24647244 [1,0,0,1,0,0|2,0,0]=4 2738 B13R2.1 CO\C=C/1\CCc2ccccc12 Amb25114080 [1,0,0,1,0,0|0,0,1]=3 2739 B13R2.1 CO\N=C/1\CCc2ccccc21 Amb22752143 [1,0,0,1,0,0|1,0,1]=4 2740 B13R2.1 CSCC1CCc2ccccc21 Amb25307253 [1,0,0,1,0,0|0,1,1]=4 2741 B13R2.3 C1=NCC(CN1)c2ccccc2 Amb16210072 [1,0,0,1,0,0|2,0,0]=4 2742 B13R2.3 C1C=CCC(N1)c2ccccc2 Amb25827021 [1,0,0,1,0,0|2,0,0]=4 2743 B13R2.3 C1C=CCC(O1)c2ccccc2 Amb25276707 [1,0,0,1,0,0|2,0,0]=4 2744 B13R2.3 C1C=CCCC1c2ccccc2 Amb22731850 [1,0,0,1,0,0|1,0,0]=3 2745 B13R2.3 C1C=CC[C@H](N1)c2ccccc2 Amb25047356 [1,0,0,1,0,0|2,0,0]=4 2746 B13R2.3 C1CC(CCN1)c2ccccc2 Amb22491685 [1,0,0,1,0,0|2,0,0]=4 2747 B13R2.3 C1CC(CCO1)c2ccccc2 Amb21856446 [1,0,0,1,0,0|2,0,0]=4 2748 B13R2.3 C1CCC(CN1)c2ccccc2 Amb1995213 [1,0,0,1,0,0|1,0,1]=4 2749 B13R2.3 C1CCC(CN1)c2ccccc2 Amb2236473 [1,0,0,1,0,0|1,0,1]=4 2750 B13R2.3 C1CCC(CS1)c2ccccc2 Amb16764110 [1,0,0,1,0,0|0,1,1]=4 2751 B13R2.3 C1NC=NCC1c2ccccc2 Amb22536298 [1,0,0,1,0,0|2,0,0]=4 2752 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb19888168 [1,0,0,1,0,0|1,0,1]=4 2753 B13R2.3 C1NCCC[C@@H]1c2ccccc2 Amb22755507 [1,0,0,1,0,0|1,0,1]=4 2754 B13R2.3 C1NCCC[C@H]1c2ccccc2 Amb19888364 [1,0,0,1,0,0|1,0,1]=4 2755 B13R2.3 C1OCCCC1c2c[n]ccc2 Amb24320762 [1,0,0,1,0,0|1,0,1]=4 2756 B13R2.3 C1OCCCC1c2cc[n]cc2 Amb24320761 [1,0,0,1,0,0|1,0,1]=4 2757 B13R2.3 C1OCCCC1c2cccc[n]2 Amb24320763 [1,0,0,1,0,0|1,0,1]=4 2758 B13R2.3 C1OCCNC1c2ccccc2 Amb18528726 [1,0,0,1,0,0|1,0,1]=4 2759 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb20242902 [1,0,0,1,0,0|1,0,1]=4 2760 B13R2.3 C1OCCN[C@@H]1c2ccccc2 Amb22274558 [1,0,0,1,0,0|1,0,1]=4 2761 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb20242901 [1,0,0,1,0,0|1,0,1]=4 2762 B13R2.3 C1OCCN[C@H]1c2ccccc2 Amb24077482 [1,0,0,1,0,0|1,0,1]=4 2763 B13R2.3 C1OCCOC1c2ccccc2 Amb24487623 [1,0,0,1,0,0|1,0,1]=4 2764 B13R2.3 N1CCC(CC1)c2ccccc2 Amb1019521 [1,0,0,1,0,0|2,0,0]=4 2765 B13R2.3 N1CCC(CC1)c2ccccc2 Amb2099643 [1,0,0,1,0,0|2,0,0]=4 2766 B13R2.3 O1CCNC(C1)c2ccccc2 Amb10068848 [1,0,0,1,0,0|1,0,1]=4 2767 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [1,0,0,1,0,0|2,0,0]=4 2768 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [1,0,0,1,0,0|1,0,1]=4 2769 B13R2.15 C[C@H]1NCC[C@H]1c2ccccc2 Amb24607383 [1,0,0,1,0,0|2,0,0]=4 2770 B13R2.25 CCNC1CC1c2ccccc2 Amb18983170 [1,0,0,1,0,0|2,0,0]=4 2771 B13R2.25 CNCC1CC1c2ccccc2 Amb17568106 [1,0,0,1,0,0|1,0,1]=4 2772 B13R2.25 CNC[C@@H]1CC1c2ccccc2 Amb17605573 [1,0,0,1,0,0|1,0,1]=4 2773 B13R2.25 CNC[C@H]1C[C@@H]1c2ccccc2 Amb24519290 [1,0,0,1,0,0|1,0,1]=4 2774 B13R2.27 CC1NCC1Cc2ccccc2 Amb25149817 [1,0,0,1,0,0|2,0,0]=4 2775 B13R2.56 CN[C@@H]1CC[C@H]1c2ccccc2 Amb25339675 [1,0,0,1,0,0|1,0,1]=4 2776 B13R2.56 N\N=C/1\CCC1c2ccccc2 Amb25855473 [1,0,0,1,0,0|2,0,0]=4 2777 B13R2.56 O\N=C/1\CCC1c2ccccc2 Amb25247166 [1,0,0,1,0,0|2,0,0]=4 2778 B13R2.64 C(C1CCCC1)c2ccccc2 Amb25116668 [1,0,0,1,0,0|1,0,1]=4 2779 B13R2.64 C1N=CNC1Cc2ccccc2 Amb25201736 [1,0,0,1,0,0|2,0,0]=4 2780 B13R2.64 C1NC(CO1)Cc2ccccc2 Amb18563410 [1,0,0,1,0,0|1,0,1]=4 2781 B13R2.64 C1NCCC1Cc2ccccc2 Amb24097496 [1,0,0,1,0,0|1,0,1]=4 2782 B13R2.64 C1NCC[C@@H]1Cc2ccccc2 Amb24484248 [1,0,0,1,0,0|1,0,1]=4 2783 B13R2.64 C1OCCC1Nc2ccccc2 Amb25310936 [1,0,0,1,0,0|1,0,1]=4 2784 B13R2.64 C1OCCC1Oc2ccccc2 Amb24713722 [1,0,0,1,0,0|1,0,1]=4 2785 B13R2.64 C1OCCN1Cc2ccccc2 Amb22229191 [1,0,0,1,0,0|1,0,1]=4 2786 B13R2.1028 CCCCC1Cc2ccccc12 Amb17758498 [1,0,0,1,0,0|1,0,1]=4 2787 B13R2.1028 CCNCC1Cc2ccccc21 Amb18289168 [1,0,0,1,0,0|2,0,0]=4 2788 B13R2.1028 CNCCC1Cc2ccccc21 Amb25723615 [1,0,0,1,0,0|1,0,1]=4 2789 B13R2.1028 CONCC1Cc2ccccc21 Amb24725780 [1,0,0,1,0,0|1,0,0]=3 2790 B13R2.1613 CCC1=NCCc2ccccc21 Amb25035624 [1,0,0,1,0,0|2,0,0]=4 2791 B13R2.1613 CCN1CCCc2c1cccc2 Amb15691608 [1,0,0,1,0,0|2,0,0]=4 2792 B13R2.1613 CN[C@@H]1CCCc2ccccc21 Amb20241467 [1,0,0,1,0,0|1,0,1]=4 2793 B13R2.1613 CN[C@H]1CCCc2ccccc21 Amb20241521 [1,0,0,1,0,0|1,0,1]=4 2794 B13R2.1613 COC1=NCCc2ccccc21 Amb24665738 [1,0,0,1,0,0|1,0,0]=3 2795 B13R2.1613 COC1CCCc2c1cccc2 Amb2228261 [1,0,0,1,0,0|0,0,1]=3 2796 B13R2.1613 COC1CCNc2ccccc21 Amb18062248 [1,0,0,1,0,0|1,0,1]=4 2797 B13R2.1613 COC1CNCc2ccccc21 Amb18645915 [1,0,0,1,0,0|1,0,1]=4 2798 B13R2.1613 COC1OCCc2ccccc21 Amb22284603 [1,0,0,1,0,0|1,0,1]=4 2799 B13R2.1613 CSC1=NCCc2ccccc21 Amb25317689 [1,0,0,1,0,0|1,1,0]=4 2800 B13R2.1613 CSC1CCCc2ccccc21 Amb24575820 [1,0,0,1,0,0|0,1,1]=4 2801 B13R2.1613 C\C=C/1\NCCc2ccccc21 Amb25124113 [1,0,0,1,0,0|2,0,0]=4 2802 B13R2.1613 Cl\C=C/1\CCCc2ccccc21 Amb24692679 [1,0,0,1,0,0|2,0,0]=4 2803 B13R2.1613 OOC1CCCc2ccccc12 Amb17938665 [1,0,0,1,0,0|1,0,1]=4 2804 B13R2.1613 O\N=C\1/CCCc2c1cccc2 Amb1948669 [1,0,0,1,0,0|2,0,0]=4 2805 B13R2.1613 O\N=C\1/CCCc2ccccc21 Amb18034226 [1,0,0,1,0,0|2,0,0]=4 2806 B13R2.2382 C(OCC1CO1)c2ccccc2 Amb22351939 [1,0,0,1,0,0|1,0,1]=4 2807 B13R2.2382 O(Cc1ccccc1)CC2OC2 Amb1152968 [1,0,0,1,0,0|1,0,1]=4 2808 B13R2.2383 C(NC1COC1)c2ccccc2 Amb22586474 [1,0,0,1,0,0|1,0,1]=4 2809 B13R2.2383 C(NC1COC1)c2ccccc2 Amb22899641 [1,0,0,1,0,0|1,0,1]=4 2810 B13R2.2383 C1NCC1CCc2ccccc2 Amb25266065 [1,0,0,1,0,0|1,0,1]=4 2811 B13R2.5252 CC1NCCCc2ccccc21 Amb25685960 [1,0,0,1,0,0|2,0,0]=4 2812 B13R2.5252 C[C@H]1NCCCc2ccccc21 Amb24451232 [1,0,0,1,0,0|2,0,0]=4 2813 B13R2.10589 C1CCCCCc2ccc1cc2 Amb24713554 [1,0,0,1,0,0|1,0,1]=4 2814 B13R2.10 C=C1COC(C1)c2ccccc2 Amb25692265 [1,0,0,1,0,0|2,0,0]=4 2815 B13R2.10 CC1=NC(CO1)c2ccccc2 Amb24754160 [1,0,0,1,0,0|2,0,0]=4 2816 B13R2.10 CC=1CNC(C1)c2ccccc2 Amb24727039 [1,0,0,1,0,0|2,0,0]=4 2817 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [1,0,0,1,0,0|2,0,0]=4 2818 B13R2.10 CN1CCC(O1)c2ccccc2 Amb22304711 [1,0,0,1,0,0|1,0,1]=4 2819 B13R2.10 C[C@@H]1CC[C@H](N1)c2ccccc2 Amb24627148 [1,0,0,1,0,0|1,0,1]=4 2820 B13R2.10 C[C@H]1CC[C@H](N1)c2ccccc2 Amb24519292 [1,0,0,1,0,0|1,0,1]=4 2821 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [1,0,0,1,0,0|2,0,0]=4 2822 B13R2.10 NC1=NCC(O1)c2ccccc2 Amb17608294 [1,0,0,1,0,0|2,0,0]=4 2823 B13R2.10 NC1CCC(C1)c2ccccc2 Amb17400101 [1,0,0,1,0,0|1,0,1]=4 2824 B13R2.10 NC=1CCC(N1)c2ccccc2 Amb24391515 [1,0,0,1,0,0|2,0,0]=4 2825 B13R2.10 O=C1C=CC(O1)c2ccccc2 Amb24090251 [1,0,0,1,0,0|0,0,2]=4 2826 B13R2.10 O=C1CC(CC1)c2c[n]c[n]c2 Amb25233832 [1,0,0,1,0,0|2,0,0]=4 2827 B13R2.10 O=C1CC(CC1)c2c[n]cc[n]2 Amb24413348 [1,0,0,1,0,0|2,0,0]=4 2828 B13R2.10 O=C1CC=C(O1)c2ccccc2 Amb10570673 [1,0,0,1,0,0|0,0,2]=4 2829 B13R2.10 O=C1CCC(=C1)c2ccccc2 Amb10669546 [1,0,0,1,0,0|0,0,2]=4 2830 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [1,0,0,1,0,0|0,0,0]=2 2831 B13R2.10 O=C1CCC(C1)c2ccccn2 Amb17138526 [1,0,0,1,0,0|1,0,0]=3 2832 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [1,0,0,1,0,0|1,0,0]=3 2833 B13R2.10 O=C1CCC(C1)c2ccncc2 Amb17138528 [1,0,0,1,0,0|1,0,0]=3 2834 B13R2.10 O=C1CCC(N1)c2cccc[n]2 Amb25237487 [1,0,0,1,0,0|2,0,0]=4 2835 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [1,0,0,1,0,0|1,0,0]=3 2836 B13R2.10 O=C1CCC(N1)c2cccnc2 Amb17618670 [1,0,0,1,0,0|2,0,0]=4 2837 B13R2.10 O=C1CCC(O1)c2cccnc2 Amb17619714 [1,0,0,1,0,0|1,0,0]=3 2838 B13R2.10 O=C1CC[C@@H](N1)c2ccc[n]c2 Amb25233097 [1,0,0,1,0,0|2,0,0]=4 2839 B13R2.10 O=C1CN(CC1)c2cc[n]cc2 Amb23449311 [1,0,0,1,0,0|2,0,0]=4 2840 B13R2.10 O=C1CN(CN1)c2ccccc2 Amb24079614 [1,0,0,1,0,0|2,0,0]=4 2841 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [1,0,0,1,0,0|1,0,0]=3 2842 B13R2.10 O=C1CNC(N1)c2ccccc2 Amb24342220 [1,0,0,1,0,0|2,0,0]=4 2843 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [1,0,0,1,0,0|1,0,0]=3 2844 B13R2.10 O=C1COC(N1)c2ccccc2 Amb25766459 [1,0,0,1,0,0|2,0,0]=4 2845 B13R2.10 O=C1CO[C@@H](N1)c2ccccc2 Amb24366993 [1,0,0,1,0,0|2,0,0]=4 2846 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [1,0,0,1,0,0|1,0,0]=3 2847 B13R2.10 O=C1CSC(N1)c2ccccc2 Amb2221753 [1,0,0,1,0,0|2,0,0]=4 2848 B13R2.10 O=C1CSC(O1)c2ccccc2 Amb25793869 [1,0,0,1,0,0|1,0,0]=3 2849 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [1,0,0,1,0,0|0,0,0]=2 2850 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [1,0,0,1,0,0|1,0,0]=3 2851 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [1,0,0,1,0,0|0,0,0]=2 2852 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [1,0,0,1,0,0|1,0,0]=3 2853 B13R2.10 O=C1NC(CS1)c2ccccc2 Amb23439132 [1,0,0,1,0,0|2,0,0]=4 2854 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [1,0,0,1,0,0|1,0,0]=3 2855 B13R2.10 O=C1NCC(C1)c2ccccn2 Amb13952281 [1,0,0,1,0,0|2,0,0]=4 2856 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [1,0,0,1,0,0|2,0,0]=4 2857 B13R2.10 O=C1NCC(C1)c2ccncc2 Amb17400108 [1,0,0,1,0,0|2,0,0]=4 2858 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [1,0,0,1,0,0|2,0,0]=4 2859 B13R2.10 O=C1NCC(O1)c2cc[n]cc2 Amb18639408 [1,0,0,1,0,0|2,0,0]=4 2860 B13R2.10 O=C1NCC(O1)c2cccc[n]2 Amb18639394 [1,0,0,1,0,0|2,0,0]=4 2861 B13R2.10 O=C1NCC(O1)c2ccccc2 Amb16232576 [1,0,0,1,0,0|1,0,0]=3 2862 B13R2.10 O=C1NCC(O1)c2cccnc2 Amb17232462 [1,0,0,1,0,0|2,0,0]=4 2863 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [1,0,0,1,0,0|2,0,0]=4 2864 B13R2.10 O=C1NC[C@@H](O1)c2ccccc2 Amb22338660 [1,0,0,1,0,0|1,0,0]=3 2865 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [1,0,0,1,0,0|2,0,0]=4 2866 B13R2.10 O=C1NC[C@H](O1)c2ccccc2 Amb24574681 [1,0,0,1,0,0|1,0,0]=3 2867 B13R2.10 O=C1NC[C@H](S1)c2ccccc2 Amb25246623 [1,0,0,1,0,0|1,1,0]=4 2868 B13R2.10 O=C1N[C@@H](CS1)c2ccccc2 Amb24653499 [1,0,0,1,0,0|2,0,0]=4 2869 B13R2.10 O=C1SSC(C1)c2ccccc2 Amb16757360 [1,0,0,1,0,0|2,0,0]=4 2870 B13R2.10 OC1=NN(CC1)c2ccccc2 Amb1811510 [1,0,0,1,0,0|2,0,0]=4 2871 B13R2.10 OC1CCC(C1)c2ccccc2 Amb17400115 [1,0,0,1,0,0|0,0,2]=4 2872 B13R2.10 OC1CCC(O1)c2ccccc2 Amb22752551 [1,0,0,1,0,0|0,0,2]=4 2873 B13R2.10 OC1CC[C@@H](O1)c2ccccc2 Amb22752552 [1,0,0,1,0,0|0,0,2]=4 2874 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [1,0,0,1,0,0|1,0,1]=4 2875 B13R2.10 S=C1NC[C@@H](O1)c2ccccc2 Amb24728461 [1,0,0,1,0,0|1,1,0]=4 2876 B13R2.31 NC1CC(Cc2ccccc2)C1 Amb23401475 [1,0,0,1,0,0|1,0,1]=4 2877 B13R2.31 O=C1CC(C1)Oc2ccccc2 Amb23439309 [1,0,0,1,0,0|1,0,0]=3 2878 B13R2.31 O=C1CC(Cc2ccccc2)C1 Amb23401474 [1,0,0,1,0,0|0,0,0]=2 2879 B13R2.31 O=C1CN(C1)Cc2ccccc2 Amb10602421 [1,0,0,1,0,0|1,0,0]=3 2880 B13R2.31 O=C1C[C@@H](N1)Sc2ccccc2 Amb25119229 [1,0,0,1,0,0|2,0,0]=4 2881 B13R2.31 O=C1C[C@H](Cc2cccc[n]2)N1 Amb24497165 [1,0,0,1,0,0|2,0,0]=4 2882 B13R2.31 O=C1C[C@H](Cc2ccccc2)N1 Amb24757761 [1,0,0,1,0,0|1,0,0]=3 2883 B13R2.31 OC1CC(Cc2ccccc2)C1 Amb23401472 [1,0,0,1,0,0|0,0,2]=4 2884 B13R2.72 CC(=C)C1CNc2ccccc21 Amb25777880 [1,0,0,1,0,0|2,0,0]=4 2885 B13R2.72 CC(=O)C1C=Cc2ccccc21 Amb25735092 [1,0,0,1,0,0|0,0,2]=4 2886 B13R2.72 CC(=O)C1CCc2ccccc21 Amb24400099 [1,0,0,1,0,0|0,0,0]=2 2887 B13R2.72 CC(=O)C1CNc2ccccc21 Amb24393046 [1,0,0,1,0,0|1,0,0]=3 2888 B13R2.72 CC(=O)C1COc2ccccc21 Amb23586289 [1,0,0,1,0,0|1,0,0]=3 2889 B13R2.72 CC(=O)C1CSc2ccccc21 Amb24435646 [1,0,0,1,0,0|1,0,0]=3 2890 B13R2.72 CC(=O)N1CCc2c[n]ccc12 Amb25847503 [1,0,0,1,0,0|2,0,0]=4 2891 B13R2.72 CC(=O)N1CCc2cc[n]cc12 Amb23412123 [1,0,0,1,0,0|2,0,0]=4 2892 B13R2.72 CC(=O)[C@@H]1CCc2ccccc21 Amb25834379 [1,0,0,1,0,0|0,0,0]=2 2893 B13R2.72 CC(=O)[C@H]1CCc2ccccc21 Amb25756942 [1,0,0,1,0,0|0,0,0]=2 2894 B13R2.72 C[C@@H](N)C1CCc2ccccc21 Amb25259826 [1,0,0,1,0,0|1,0,1]=4 2895 B13R2.72 C[C@@H](O)C1CCc2ccccc21 Amb25077224 [1,0,0,1,0,0|0,0,2]=4 2896 B13R2.72 C[C@H](O)C1CCc2ccccc21 Amb25378827 [1,0,0,1,0,0|0,0,2]=4 2897 B13R2.72 NC(=N)C1CCc2ccccc21 Amb24484327 [1,0,0,1,0,0|2,0,0]=4 2898 B13R2.72 NC(=O)C1CCc2[n]cccc21 Amb24071419 [1,0,0,1,0,0|2,0,0]=4 2899 B13R2.72 NC(=O)C1CCc2ccc[n]c21 Amb24071778 [1,0,0,1,0,0|2,0,0]=4 2900 B13R2.72 NC(=O)C1CNc2ccccc21 Amb19320765 [1,0,0,1,0,0|2,0,0]=4 2901 B13R2.72 NC(=O)C1NCc2ccccc21 Amb25053931 [1,0,0,1,0,0|2,0,0]=4 2902 B13R2.72 NC(=O)N1CCc2c1cccc2 Amb1124478 [1,0,0,1,0,0|2,0,0]=4 2903 B13R2.72 O=C(Cl)C1CCc2ccccc21 Amb24397018 [1,0,0,1,0,0|1,0,0]=3 2904 B13R2.72 O=C(Cl)C1COc2ccccc21 Amb24436426 [1,0,0,1,0,0|2,0,0]=4 2905 B13R2.72 O=C(Cl)N1CCc2ccccc12 Amb20670451 [1,0,0,1,0,0|2,0,0]=4 2906 B13R2.72 OC(=O)C1C=Cc2c1cccc2 Amb17470411 [1,0,0,1,0,0|0,0,2]=4 2907 B13R2.72 OC(=O)C1CCc2[n]c[n]cc21 Amb18829043 [1,0,0,1,0,0|2,0,0]=4 2908 B13R2.72 OC(=O)C1CCc2c[n]ccc21 Amb25376359 [1,0,0,1,0,0|1,0,0]=3 2909 B13R2.72 OC(=O)C1CCc2ccc[n]c21 Amb22372226 [1,0,0,1,0,0|1,0,0]=3 2910 B13R2.72 OC(=O)C1CCc2ccccc21 Amb18538487 [1,0,0,1,0,0|0,0,0]=2 2911 B13R2.72 OC(=O)C1CN=C2C=CC=CN21 Amb24101574 [1,0,0,1,0,0|2,0,0]=4 2912 B13R2.72 OC(=O)C1CNc2ccccc21 Amb22497686 [1,0,0,1,0,0|1,0,0]=3 2913 B13R2.72 OC(=O)C1COc2ccccc21 Amb19372915 [1,0,0,1,0,0|1,0,0]=3 2914 B13R2.72 OC(=O)C1CSc2ccccc21 Amb19335022 [1,0,0,1,0,0|1,0,0]=3 2915 B13R2.72 OC(=O)C1NCc2c[n]ccc21 Amb18829011 [1,0,0,1,0,0|2,0,0]=4 2916 B13R2.72 OC(=O)C1NCc2ccccc21 Amb22491461 [1,0,0,1,0,0|1,0,0]=3 2917 B13R2.72 OC(=O)C1OCc2ccccc21 Amb18829056 [1,0,0,1,0,0|1,0,0]=3 2918 B13R2.72 OC(=O)N1CSc2ccccc12 Amb24061895 [1,0,0,1,0,0|2,0,0]=4 2919 B13R2.72 OC(=O)[C@@H]1CCc2ccccc21 Amb24729539 [1,0,0,1,0,0|0,0,0]=2 2920 B13R2.72 OC(=O)[C@@H]1CNc2ccccc21 Amb25701751 [1,0,0,1,0,0|1,0,0]=3 2921 B13R2.72 OC(=O)[C@@H]1COc2ccccc21 Amb24539298 [1,0,0,1,0,0|1,0,0]=3 2922 B13R2.72 OC(=O)[C@@H]1NCc2ccccc21 Amb22748827 [1,0,0,1,0,0|1,0,0]=3 2923 B13R2.72 OC(=O)[C@H]1CCc2ccccc21 Amb24470066 [1,0,0,1,0,0|0,0,0]=2 2924 B13R2.72 OC(=O)[C@H]1CSc2ccccc21 Amb24701742 [1,0,0,1,0,0|1,0,0]=3 2925 B13R2.72 OC(=O)[C@H]1NCc2ccccc21 Amb25200954 [1,0,0,1,0,0|1,0,0]=3 2926 B13R2.163 BrC=1CCCc2ccccc2C1 Amb25244811 [1,0,0,1,0,0|1,0,1]=4 2927 B13R2.163 CN1CCCc2c(C1)cccc2 Amb10572356 [1,0,0,1,0,0|2,0,0]=4 2928 B13R2.163 NC1Cc2ccccc2CCC1 Amb24355951 [1,0,0,1,0,0|1,0,1]=4 2929 B13R2.163 NC=1Cc2ccccc2CCN1 Amb22263623 [1,0,0,1,0,0|2,0,0]=4 2930 B13R2.163 N[C@H]1Cc2ccccc2CCC1 Amb25151132 [1,0,0,1,0,0|1,0,1]=4 2931 B13R2.163 O=C1CCCc2c(N1)cccc2 Amb1077569 [1,0,0,1,0,0|1,0,0]=3 2932 B13R2.163 O=C1CCCc2ccc[n]c2N1 Amb21962431 [1,0,0,1,0,0|2,0,0]=4 2933 B13R2.163 O=C1CCCc2ccccc2O1 Amb22900954 [1,0,0,1,0,0|0,0,0]=2 2934 B13R2.163 O=C1CCNc2c(N1)cccc2 Amb1666975 [1,0,0,1,0,0|2,0,0]=4 2935 B13R2.163 O=C1CCNc2ccccc2N1 Amb21857722 [1,0,0,1,0,0|2,0,0]=4 2936 B13R2.163 O=C1CCOc2c(N1)cccc2 Amb10608982 [1,0,0,1,0,0|2,0,0]=4 2937 B13R2.163 O=C1CCSc2c(N1)cccc2 Amb1154582 [1,0,0,1,0,0|2,0,0]=4 2938 B13R2.163 O=C1CN=Cc2ccccc2O1 Amb24060690 [1,0,0,1,0,0|1,0,1]=4 2939 B13R2.163 O=C1CNCc2c(N1)cccc2 Amb17606145 [1,0,0,1,0,0|2,0,0]=4 2940 B13R2.163 O=C1COCc2ccccc2N1 Amb19516346 [1,0,0,1,0,0|2,0,0]=4 2941 B13R2.163 O=C1Cc2cc[n]cc2CCC1 Amb25730512 [1,0,0,1,0,0|1,0,0]=3 2942 B13R2.163 O=C1Cc2ccc[n]c2CCC1 Amb25097103 [1,0,0,1,0,0|1,0,0]=3 2943 B13R2.163 O=C1Cc2ccccc2NCC1 Amb18829955 [1,0,0,1,0,0|1,0,0]=3 2944 B13R2.163 O=C1Cc2ccccc2OCC1 Amb24352115 [1,0,0,1,0,0|1,0,0]=3 2945 B13R2.163 O=C1NCCc2c(C1)cccc2 Amb16203437 [1,0,0,1,0,0|1,0,0]=3 2946 B13R2.163 O=C1Nc2ccccc2CCO1 Amb24495939 [1,0,0,1,0,0|2,0,0]=4 2947 B13R2.163 S=C1Cc2ccccc2CCN1 Amb25826588 [1,0,0,1,0,0|1,1,0]=4 2948 B13R2.219 O=S1(=O)CCC1c2ccccc2 Amb24496772 [1,0,0,1,0,0|1,0,1]=4 2949 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [1,0,0,1,0,0|1,0,0]=3 2950 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [1,0,0,1,0,0|0,0,0]=2 2951 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [1,0,0,1,0,0|0,0,0]=2 2952 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cc[n]cc2 Amb25375191 [1,0,0,1,0,0|2,0,0]=4 2953 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [1,0,0,1,0,0|1,0,0]=3 2954 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [1,0,0,1,0,0|0,0,0]=2 2955 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2cc[n]cc2 Amb25174919 [1,0,0,1,0,0|2,0,0]=4 2956 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccc[n]c2 Amb24649931 [1,0,0,1,0,0|2,0,0]=4 2957 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [1,0,0,1,0,0|1,0,0]=3 2958 B13R2.423 CC(C)C1CC1c2ccccc2 Amb24070198 [1,0,0,1,0,0|1,0,1]=4 2959 B13R2.423 CC(C)[C@@H]1C[C@H]1c2ccccc2 Amb25253110 [1,0,0,1,0,0|1,0,1]=4 2960 B13R2.423 CC(C)[C@H]1C[C@H]1c2ccccc2 Amb24068901 [1,0,0,1,0,0|1,0,1]=4 2961 B13R2.423 CC(C1CC1c2ccccc2)N Amb10610180 [1,0,0,1,0,0|1,0,1]=4 2962 B13R2.423 CC(C1CC1c2ccccc2)O Amb17605479 [1,0,0,1,0,0|0,0,2]=4 2963 B13R2.423 CC(O)[C@@H]1C[C@@H]1c2ccccc2 Amb25306520 [1,0,0,1,0,0|0,0,2]=4 2964 B13R2.423 C[C@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520371 [1,0,0,1,0,0|0,0,2]=4 2965 B13R2.423 C[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24583667 [1,0,0,1,0,0|0,0,2]=4 2966 B13R2.423 NC(=N)C1CC1c2ccccc2 Amb25242569 [1,0,0,1,0,0|2,0,0]=4 2967 B13R2.423 NC(=O)C1CC1c2ccc[n]c2 Amb25701875 [1,0,0,1,0,0|2,0,0]=4 2968 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [1,0,0,1,0,0|1,0,0]=3 2969 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24678885 [1,0,0,1,0,0|2,0,0]=4 2970 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccc[n]c2 Amb24709317 [1,0,0,1,0,0|2,0,0]=4 2971 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25294667 [1,0,0,1,0,0|2,0,0]=4 2972 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [1,0,0,1,0,0|2,0,0]=4 2973 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24724910 [1,0,0,1,0,0|2,0,0]=4 2974 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [1,0,0,1,0,0|1,0,0]=3 2975 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [1,0,0,1,0,0|1,0,0]=3 2976 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [1,0,0,1,0,0|1,0,0]=3 2977 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [1,0,0,1,0,0|1,0,0]=3 2978 B13R2.423 O=C(Cl)C1OC1c2ccccc2 Amb25275213 [1,0,0,1,0,0|2,0,0]=4 2979 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [1,0,0,1,0,0|2,0,0]=4 2980 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [1,0,0,1,0,0|1,0,0]=3 2981 B13R2.423 O=C(Cl)[C@H]1O[C@H]1c2ccccc2 Amb24621250 [1,0,0,1,0,0|2,0,0]=4 2982 B13R2.423 OB(O)[C@@H]1C[C@H]1c2ccccc2 Amb24711708 [1,0,0,1,0,0|1,0,1]=4 2983 B13R2.423 OC(=O)C1CC1c2c[n]c[n]c2 Amb23571328 [1,0,0,1,0,0|2,0,0]=4 2984 B13R2.423 OC(=O)C1CC1c2cc[n]c[n]2 Amb24662852 [1,0,0,1,0,0|2,0,0]=4 2985 B13R2.423 OC(=O)C1CC1c2cc[n]cc2 Amb19514911 [1,0,0,1,0,0|1,0,0]=3 2986 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2cccc[n]2 Amb25209805 [1,0,0,1,0,0|1,0,0]=3 2987 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [1,0,0,1,0,0|0,0,0]=2 2988 B13R2.423 OC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25299768 [1,0,0,1,0,0|1,0,0]=3 2989 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [1,0,0,1,0,0|1,0,0]=3 2990 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [1,0,0,1,0,0|1,0,0]=3 2991 B13R2.423 OC(=O)[C@@H]1S[C@H]1c2ccccc2 Amb25286929 [1,0,0,1,0,0|1,0,0]=3 2992 B13R2.423 OC(=O)[C@H]1CC1c2cc[n]cc2 Amb24685293 [1,0,0,1,0,0|1,0,0]=3 2993 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [1,0,0,1,0,0|0,0,0]=2 2994 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [1,0,0,1,0,0|0,0,0]=2 2995 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [1,0,0,1,0,0|1,0,0]=3 2996 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [1,0,0,1,0,0|1,0,0]=3 2997 B13R2.3122 CC1(C)CCCc2ccccc12 Amb25328610 [1,0,0,1,0,0|1,0,1]=4 2998 B13R2.3122 CC1(N)CCCc2c1cccc2 Amb13952456 [1,0,0,1,0,0|1,0,1]=4 2999 B13R2.5881 CC(=O)CC1Cc2ccccc21 Amb25129209 [1,0,0,1,0,0|0,0,0]=2 3000 B13R2.5881 CC(=O)NC1Cc2ccccc12 Amb17778879 [1,0,0,1,0,0|1,0,0]=3 3001 B13R2.5881 CC(=O)OC1Cc2ccccc12 Amb17778687 [1,0,0,1,0,0|1,0,0]=3 3002 B13R2.5881 CC(=O)\C=C\1/Cc2ccccc21 Amb21948332 [1,0,0,1,0,0|0,0,2]=4 3003 B13R2.5881 CC(Cl)CC1Cc2ccccc21 Amb24570076 [1,0,0,1,0,0|1,0,1]=4 3004 B13R2.5881 CC(N)CC1Cc2ccccc21 Amb24738028 [1,0,0,1,0,0|1,0,1]=4 3005 B13R2.5881 CN(C)CC1Cc2ccccc21 Amb22446492 [1,0,0,1,0,0|2,0,0]=4 3006 B13R2.5881 NC(=N)CC1Cc2ccccc21 Amb25150145 [1,0,0,1,0,0|2,0,0]=4 3007 B13R2.5881 OC(=O)CC1=Cc2ccccc21 Amb25148617 [1,0,0,1,0,0|0,0,2]=4 3008 B13R2.5881 OC(=O)CC1Cc2ccccc21 Amb25279494 [1,0,0,1,0,0|0,0,0]=2 3009 B13R2.32 CC1C(=O)CNc2ccccc21 Amb25276622 [0,0,0,1,1,0|2,0,0]=4 3010 B13R2.32 CC1C(=O)CSc2ccccc21 Amb24620041 [0,0,0,1,1,0|2,0,0]=4 3011 B13R2.32 CN1C(=O)OCc2ccccc12 Amb25220213 [0,0,0,1,1,0|2,0,0]=4 3012 B13R2.32 NN1C(=O)CCc2ccccc12 Amb18645671 [0,0,0,1,1,0|2,0,0]=4 3013 B13R2.32 O=C1CCc2c(N1C)cccc2 Amb17322846 [0,0,0,1,1,0|1,0,0]=3 3014 B13R2.32 O=C1CCc2c(N1O)cccc2 Amb1099957 [0,0,0,1,1,0|2,0,0]=4 3015 B13R2.32 O=C1CCc2ccccc2C1Br Amb24680538 [0,0,0,1,1,0|2,0,0]=4 3016 B13R2.32 O=C1CCc2ccccc2C1F Amb25092927 [0,0,0,1,1,0|2,0,0]=4 3017 B13R2.32 O=C1COc2c(N1C)cccc2 Amb1351378 [0,0,0,1,1,0|2,0,0]=4 3018 B13R2.33 O=C1C=Cc2c(CC1)cccc2 Amb17593958 [0,0,0,1,1,0|1,0,1]=4 3019 B13R2.33 O=C1CCc2ccccc2CO1 Amb24525708 [0,0,0,1,1,0|0,0,0]=2 3020 B13R2.33 O=C1CNc2c(CN1)cccc2 Amb17620443 [0,0,0,1,1,0|2,0,0]=4 3021 B13R2.33 O=C1COc2c(CN1)cccc2 Amb2137257 [0,0,0,1,1,0|2,0,0]=4 3022 B13R2.33 O=C1CSc2ccccc2CC1 Amb25044274 [0,0,0,1,1,0|2,0,0]=4 3023 B13R2.33 O=C1NCc2ccccc2CO1 Amb24100846 [0,0,0,1,1,0|1,0,0]=3 3024 B13R2.33 OC1CCc2ccccc2CO1 Amb22227713 [0,0,0,1,1,0|0,0,2]=4 3025 B13R2.57 CNC=1CCc2ccccc2C1 Amb25784738 [0,0,0,1,1,0|2,0,0]=4 3026 B13R2.57 COC=1CSc2ccccc2N1 Amb24116116 [0,0,0,1,1,0|2,0,0]=4 3027 B13R2.57 CSC=1CCc2ccccc2N1 Amb24666023 [0,0,0,1,1,0|1,1,0]=4 3028 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,0,0,1,1,0|1,0,0]=3 3029 B13R2.373 CC1C(NC1=O)c2ccccc2 Amb19149073 [0,0,0,1,1,0|2,0,0]=4 3030 B13R2.373 CN1C(CC1=O)c2ccc[n]c2 Amb25208120 [0,0,0,1,1,0|2,0,0]=4 3031 B13R2.373 C[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25206665 [0,0,0,1,1,0|2,0,0]=4 3032 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,0,0,1,1,0|1,0,0]=3 3033 B13R2.3203 CC1(CO1)CCc2ccccc2 Amb18798137 [0,0,0,1,1,0|1,0,1]=4 3034 B13R2.15272 C#CC(=O)C1Cc2ccccc21 Amb25341002 [0,0,0,1,1,0|1,0,1]=4 3035 B13R2.15272 C=CC(=O)C1Cc2ccccc21 Amb24483901 [0,0,0,1,1,0|1,0,1]=4 3036 B13R2.15272 COC(=N)C1Cc2ccccc21 Amb24707799 [0,0,0,1,1,0|1,0,0]=3 3037 B13R2.15272 COC(=O)C1=Cc2ccccc21 Amb20248945 [0,0,0,1,1,0|0,0,2]=4 3038 B13R2.15272 O=C(CBr)C1Cc2ccccc21 Amb25669623 [0,0,0,1,1,0|2,0,0]=4 3039 B13R2.15272 OCC(=O)C1Cc2ccccc21 Amb25319014 [0,0,0,1,1,0|2,0,0]=4 3040 B13R2.15272 ONC(=O)C1Cc2ccccc21 Amb24406877 [0,0,0,1,1,0|2,0,0]=4 3041 B13R2.12 O=C1CCC(CC1)c2cc[s]c2 Amb25836461 [0,0,0,1,1,0|2,0,0]=4 3042 B13R2.12 O=C1CCC(CC1)c2ccc[s]2 Amb18564147 [0,0,0,1,1,0|2,0,0]=4 3043 B13R2.12 O=C1CCC(CC1)c2ccco2 Amb18563610 [0,0,0,1,1,0|2,0,0]=4 3044 B13R2.12 O=C1CCC(CC1)c2ccoc2 Amb24426466 [0,0,0,1,1,0|2,0,0]=4 3045 B13R2.12 O=C1CCC(CN1)[n]2cccc2 Amb25703771 [0,0,0,1,1,0|2,0,0]=4 3046 B13R2.12 O=C1CCC(CN1)c2cccs2 Amb17400887 [0,0,0,1,1,0|2,0,0]=4 3047 B13R2.142 O=C1CC(Cc2ccc[s]2)CC1 Amb25758078 [0,0,0,1,1,0|2,0,0]=4 3048 B13R2.142 O=C1CC(Cc2ccc[s]2)CO1 Amb24663277 [0,0,0,1,1,0|1,0,0]=3 3049 B13R2.142 O=C1CC(Cc2ccco2)CC1 Amb24689479 [0,0,0,1,1,0|2,0,0]=4 3050 B13R2.142 O=C1CC(Cc2ccco2)CO1 Amb24362744 [0,0,0,1,1,0|1,0,0]=3 3051 B13R2.142 O=C1C[C@H](Cc2ccco2)CO1 Amb25722899 [0,0,0,1,1,0|1,0,0]=3 3052 B13R2.1095 COC(=O)C1CCc2o[n]cc21 Amb23596856 [0,0,0,1,1,0|2,0,0]=4 3053 B13R2.2296 COC(=O)C1CC1c2c[nH]c[n]2 Amb23560281 [0,0,0,1,1,0|2,0,0]=4 3054 B13R2.2296 COC(=O)C1CC1c2ccco2 Amb25344416 [0,0,0,1,1,0|1,0,0]=3 3055 B13R2.2348 CC1C(CCC1=O)c2cocc2 Amb24484237 [0,0,0,1,1,0|2,0,0]=4 3056 B13R2.2348 CC1[C@H](CCC1=O)c2cocc2 Amb25834397 [0,0,0,1,1,0|2,0,0]=4 3057 B15R2.4 BrCC(=O)NC1CCc2c1cccc2 Amb17329466 [0,0,0,1,0,1|2,0,0]=4 3058 B15R2.4 C#CC(=O)CC1CNc2ccccc21 Amb25843092 [0,0,0,1,0,1|1,0,1]=4 3059 B15R2.4 C=CC(=O)CC1CNc2ccccc21 Amb24446645 [0,0,0,1,0,1|1,0,1]=4 3060 B15R2.4 CCC(=O)CN1CCc2ccccc12 Amb19077872 [0,0,0,1,0,1|1,0,0]=3 3061 B15R2.4 CCC(=O)NC1COc2ccccc21 Amb24413251 [0,0,0,1,0,1|2,0,0]=4 3062 B15R2.4 CNC(=N)NC1CCc2ccccc21 Amb19072447 [0,0,0,1,0,1|2,0,0]=4 3063 B15R2.4 CNC(=O)CC1CCc2c1cccc2 Amb17234743 [0,0,0,1,0,1|1,0,0]=3 3064 B15R2.4 CNC(=O)CC1CNc2ccccc21 Amb25036755 [0,0,0,1,0,1|1,0,0]=3 3065 B15R2.4 CNC(=O)CN1CCc2ccccc12 Amb19967887 [0,0,0,1,0,1|1,0,0]=3 3066 B15R2.4 CNC(=O)NC1CCc2ccccc21 Amb24181769 [0,0,0,1,0,1|1,0,0]=3 3067 B15R2.4 CNC(=O)NC1COc2ccccc21 Amb24476348 [0,0,0,1,0,1|2,0,0]=4 3068 B15R2.4 CNC(=O)OC1CCc2ccccc21 Amb25049335 [0,0,0,1,0,1|1,0,0]=3 3069 B15R2.4 COC(=O)CC1CNc2c1cccc2 Amb17592979 [0,0,0,1,0,1|0,0,0]=2 3070 B15R2.4 COC(=O)CC1NCc2ccccc21 Amb22497860 [0,0,0,1,0,1|0,0,0]=2 3071 B15R2.4 COC(=O)C[n]1[n]cc2ccccc12 Amb19060886 [0,0,0,1,0,1|1,0,1]=4 3072 B15R2.4 COC(=O)Cc1[n][nH]c2ccccc21 Amb22263580 [0,0,0,1,0,1|1,0,1]=4 3073 B15R2.4 COC(=O)Cc1c[s]c2ccccc21 Amb24066565 [0,0,0,1,0,1|0,0,2]=4 3074 B15R2.4 COC(=O)Cc1coc2ccccc12 Amb25354938 [0,0,0,1,0,1|0,0,2]=4 3075 B15R2.4 COC(=O)Cn1cnc2c1cccc2 Amb1744624 [0,0,0,1,0,1|1,0,1]=4 3076 B15R2.4 COC(=O)NC1=CCc2ccccc12 Amb24095926 [0,0,0,1,0,1|0,0,2]=4 3077 B15R2.4 COC(=O)N[C@@H]1CCc2ccccc21 Amb24581267 [0,0,0,1,0,1|0,0,0]=2 3078 B15R2.4 COC(=O)N[C@H]1CCc2ccccc21 Amb24347058 [0,0,0,1,0,1|0,0,0]=2 3079 B15R2.4 CON(C)CC1CNc2ccccc21 Amb24555103 [0,0,0,1,0,1|2,0,0]=4 3080 B15R2.4 O=C(CCl)O[C@@H]1CCc2ccccc21 Amb25181651 [0,0,0,1,0,1|2,0,0]=4 3081 B15R2.4 ONC(=O)CC1CNc2ccccc21 Amb25704590 [0,0,0,1,0,1|2,0,0]=4 3082 B15R2.4 [K]OC(=O)CC1CNc2c1cccc2 Amb16224797 [0,0,0,1,0,1|1,0,0]=3 3083 B15R2.15 CNC1=NC(Cc2ccccc2)CS1 Amb24351509 [0,0,0,1,0,1|2,0,0]=4 3084 B15R2.15 CNC1=N[C@@H](Cc2ccccc2)CS1 Amb24716819 [0,0,0,1,0,1|2,0,0]=4 3085 B15R2.15 COC1=NC(CO1)Cc2ccccc2 Amb22549387 [0,0,0,1,0,1|1,0,0]=3 3086 B15R2.15 COC1CN(Cc2ccccc2)CC1 Amb24078346 [0,0,0,1,0,1|1,0,1]=4 3087 B15R2.29 BrC1=CCN(CC1)Cc2ccccc2 Amb13885738 [0,0,0,1,0,1|2,0,0]=4 3088 B15R2.29 C=C1CCN(CC1)Cc2ccccc2 Amb10569116 [0,0,0,1,0,1|2,0,0]=4 3089 B15R2.29 CC1CNC(CO1)Cc2ccccc2 Amb18563409 [0,0,0,1,0,1|1,0,1]=4 3090 B15R2.29 CC=1CCN(Cc2ccccc2)CC1 Amb20240699 [0,0,0,1,0,1|2,0,0]=4 3091 B15R2.29 IC=1CCN(Cc2ccccc2)CC1 Amb24511116 [0,0,0,1,0,1|2,0,0]=4 3092 B15R2.29 O=C1CCC(CC1)Cc2ccccc2 Amb13777318 [0,0,0,1,0,1|1,0,0]=3 3093 B15R2.29 O=C1CCC(CC1)Oc2cc[n]cc2 Amb25217313 [0,0,0,1,0,1|2,0,0]=4 3094 B15R2.29 O=C1CCC(CC1)Oc2cccc[n]2 Amb23598210 [0,0,0,1,0,1|2,0,0]=4 3095 B15R2.29 O=C1CCC(CC1)Oc2ccccc2 Amb25825595 [0,0,0,1,0,1|1,0,0]=3 3096 B15R2.29 O=C1CCC(CN1)Nc2cc[n]cc2 Amb25766318 [0,0,0,1,0,1|2,0,0]=4 3097 B15R2.29 O=C1CCC(Cc2ccccc2)C=C1 Amb25793582 [0,0,0,1,0,1|1,0,1]=4 3098 B15R2.29 O=C1CNC(Cc2ccccc2)=NO1 Amb24522022 [0,0,0,1,0,1|1,0,1]=4 3099 B15R2.29 O=C1CNC(Cc2ccccc2)CN1 Amb18819212 [0,0,0,1,0,1|1,0,0]=3 3100 B15R2.29 O=C1CN[C@H](Cc2ccccc2)CN1 Amb24763664 [0,0,0,1,0,1|1,0,0]=3 3101 B15R2.29 O=S1CCC(CC1)Nc2ccccc2 Amb18955527 [0,0,0,1,0,1|2,0,0]=4 3102 B15R2.29 O=S1CCC(CC1)Nc2ccccc2 Amb21988474 [0,0,0,1,0,1|2,0,0]=4 3103 B15R2.29 OC1CCC(CO1)Cc2ccccc2 Amb25356218 [0,0,0,1,0,1|0,0,2]=4 3104 B15R2.32 CC1C(=O)CCNC1c2ccccc2 Amb1778613 [0,0,0,1,0,1|1,0,0]=3 3105 B15R2.32 CN1C(CNCC1=O)c2cc[n]cc2 Amb25700145 [0,0,0,1,0,1|2,0,0]=4 3106 B15R2.32 CN1C(CNCC1=O)c2ccc[n]c2 Amb25191024 [0,0,0,1,0,1|2,0,0]=4 3107 B15R2.32 CN1[C@@H](CNCC1=O)c2ccccc2 Amb25183380 [0,0,0,1,0,1|1,0,0]=3 3108 B15R2.32 CN1[C@H](CNCC1=O)c2ccccc2 Amb25756622 [0,0,0,1,0,1|1,0,0]=3 3109 B15R2.32 O=C1CCCN(c2ccccc2)C1=O Amb25223476 [0,0,0,1,0,1|2,0,0]=4 3110 B15R2.32 OC1C(CCCC1=O)c2ccccc2 Amb25167265 [0,0,0,1,0,1|2,0,0]=4 3111 B15R2.32 OC1C(OCCC1=O)c2ccccc2 Amb24705809 [0,0,0,1,0,1|2,0,0]=4 3112 B15R2.283 CC1CC(CNc2ccccc2)CO1 Amb25166836 [0,0,0,1,0,1|1,0,1]=4 3113 B15R2.283 NC1=NC(CCc2ccccc2)CO1 Amb25376590 [0,0,0,1,0,1|1,0,0]=3 3114 B15R2.283 NC1=NC(CNc2ccccc2)CO1 Amb25804113 [0,0,0,1,0,1|2,0,0]=4 3115 B15R2.283 NC1=N[C@@H](CNc2ccccc2)CO1 Amb25814903 [0,0,0,1,0,1|2,0,0]=4 3116 B15R2.283 O=C1C=C(CO1)NCc2ccccc2 Amb23562822 [0,0,0,1,0,1|0,0,2]=4 3117 B15R2.283 O=C1C=C(CO1)OCc2ccccc2 Amb24310537 [0,0,0,1,0,1|0,0,2]=4 3118 B15R2.283 O=C1C=CC(CCc2ccccc2)N1 Amb24378116 [0,0,0,1,0,1|1,0,1]=4 3119 B15R2.283 O=C1CC(C=C1)OCc2ccccc2 Amb24375347 [0,0,0,1,0,1|1,0,1]=4 3120 B15R2.283 O=C1CC(CC1)NCc2ccccc2 Amb25754322 [0,0,0,1,0,1|1,0,0]=3 3121 B15R2.283 O=C1CC(CN1)COc2ccccc2 Amb25665268 [0,0,0,1,0,1|1,0,0]=3 3122 B15R2.283 O=C1CC(CN1)CSc2ccccc2 Amb25771687 [0,0,0,1,0,1|1,0,0]=3 3123 B15R2.283 O=C1CC(CN1)NCc2cc[n]cc2 Amb25764198 [0,0,0,1,0,1|2,0,0]=4 3124 B15R2.283 O=C1CC(CN1)OCc2ccccc2 Amb25166196 [0,0,0,1,0,1|1,0,0]=3 3125 B15R2.283 O=C1CC(CN1)\C=C\c2ccccc2 Amb24531769 [0,0,0,1,0,1|1,0,1]=4 3126 B15R2.283 O=C1CC(CO1)NCc2ccccc2 Amb24563385 [0,0,0,1,0,1|0,0,0]=2 3127 B15R2.283 O=C1CCC(CNc2ccccc2)N1 Amb25102596 [0,0,0,1,0,1|2,0,0]=4 3128 B15R2.283 O=C1CCC(CSc2ccccc2)O1 Amb25277398 [0,0,0,1,0,1|2,0,0]=4 3129 B15R2.283 O=C1CCC(N1)OCc2ccccc2 Amb25835161 [0,0,0,1,0,1|2,0,0]=4 3130 B15R2.283 O=C1CCC(NCc2ccccc2)N1 Amb24426288 [0,0,0,1,0,1|2,0,0]=4 3131 B15R2.283 O=C1CC[C@@H](CNc2ccccc2)N1 Amb25292105 [0,0,0,1,0,1|2,0,0]=4 3132 B15R2.283 O=C1CN(CC1)CCc2cc[n]cc2 Amb19060970 [0,0,0,1,0,1|2,0,0]=4 3133 B15R2.283 O=C1CN(CC1)CCc2ccc[n]c2 Amb19060959 [0,0,0,1,0,1|2,0,0]=4 3134 B15R2.283 O=C1C[C@H](C=C1)OCc2ccccc2 Amb25167796 [0,0,0,1,0,1|1,0,1]=4 3135 B15R2.283 O=C1C[C@H](CO1)NCc2ccccc2 Amb25233437 [0,0,0,1,0,1|0,0,0]=2 3136 B15R2.283 O=C1NC(CCc2ccccc2)=NO1 Amb19072880 [0,0,0,1,0,1|1,0,1]=4 3137 B15R2.283 O=C1NC(CCc2ccccc2)CO1 Amb25217512 [0,0,0,1,0,1|0,0,0]=2 3138 B15R2.283 O=C1NC(CO1)CNc2cccc[n]2 Amb24690185 [0,0,0,1,0,1|2,0,0]=4 3139 B15R2.283 O=C1NC(CO1)OCc2ccccc2 Amb25108221 [0,0,0,1,0,1|1,0,0]=3 3140 B15R2.283 O=C1NC(CO1)\C=C\c2ccccc2 Amb24336522 [0,0,0,1,0,1|0,0,2]=4 3141 B15R2.283 O=C1NC(CO1)\N=C\c2ccccc2 Amb24336701 [0,0,0,1,0,1|1,0,1]=4 3142 B15R2.283 O=C1NCC(CNc2ccccc2)O1 Amb25082861 [0,0,0,1,0,1|2,0,0]=4 3143 B15R2.283 O=C1NCC(CSc2ccccc2)O1 Amb25756159 [0,0,0,1,0,1|2,0,0]=4 3144 B15R2.283 O=C1NC[C@@H](COc2ccccc2)O1 Amb25315100 [0,0,0,1,0,1|2,0,0]=4 3145 B15R2.283 O=C1N[C@@H](CCc2ccccc2)CO1 Amb24336441 [0,0,0,1,0,1|0,0,0]=2 3146 B15R2.283 O=C1N[C@@H](CO1)C#Cc2ccccc2 Amb24409685 [0,0,0,1,0,1|0,0,2]=4 3147 B15R2.283 O=C1N[C@@H](CO1)\C=C\c2ccccc2 Amb24506561 [0,0,0,1,0,1|0,0,2]=4 3148 B15R2.283 O=C1N[C@H](CO1)\C=C\c2ccccc2 Amb24753714 [0,0,0,1,0,1|0,0,2]=4 3149 B15R2.283 O=C1OC(CO1)COc2ccccc2 Amb22446931 [0,0,0,1,0,1|1,0,0]=3 3150 B15R2.283 OC1CC(CO1)OCc2ccccc2 Amb25740552 [0,0,0,1,0,1|0,0,2]=4 3151 B15R2.283 OC1C[C@H](CO1)OCc2ccccc2 Amb25284216 [0,0,0,1,0,1|0,0,2]=4 3152 B15R2.342 O=C1CCC1COCc2ccccc2 Amb25316137 [0,0,0,1,0,1|1,0,0]=3 3153 B15R2.546 O=C1CCCCc2ccccc2CN1 Amb24594306 [0,0,0,1,0,1|1,0,0]=3 3154 B15R2.548 NC=1CCCC(CN1)c2ccccc2 Amb25672635 [0,0,0,1,0,1|2,0,0]=4 3155 B15R2.548 O=C1CCC(CCO1)c2ccccc2 Amb22337540 [0,0,0,1,0,1|1,0,0]=3 3156 B15R2.548 O=C1CCCC(CN1)c2ccccc2 Amb22642248 [0,0,0,1,0,1|1,0,0]=3 3157 B15R2.1561 COC(=O)C1CN1Cc2ccccc2 Amb22504624 [0,0,0,1,0,1|0,0,0]=2 3158 B15R2.1561 NNC(=O)C1CC1Oc2ccccc2 Amb25352766 [0,0,0,1,0,1|2,0,0]=4 3159 B15R2.1561 NNC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25109448 [0,0,0,1,0,1|2,0,0]=4 3160 B15R2.1600 COC(=O)C1CCC1c2ccccc2 Amb23453479 [0,0,0,1,0,1|0,0,0]=2 3161 B15R2.1600 COC(=O)C1CCN1c2ccccc2 Amb24368171 [0,0,0,1,0,1|0,0,0]=2 3162 B15R2.1600 NCC(=O)N1CCC1c2ccccc2 Amb25316933 [0,0,0,1,0,1|2,0,0]=4 3163 B15R2.1621 C=CC(=O)NC1CC1c2ccccc2 Amb19076487 [0,0,0,1,0,1|1,0,1]=4 3164 B15R2.1621 CCC(=O)NC1CC1c2ccccc2 Amb25141389 [0,0,0,1,0,1|1,0,0]=3 3165 B15R2.1621 CNC(=N)NC1CC1c2ccccc2 Amb19072436 [0,0,0,1,0,1|2,0,0]=4 3166 B15R2.1621 CNC(=S)NC1CC1c2ccccc2 Amb12086764 [0,0,0,1,0,1|1,1,0]=4 3167 B15R2.1621 C\C(=N\C1CC1c2ccccc2)\OC Amb22356821 [0,0,0,1,0,1|1,0,0]=3 3168 B15R2.1621 NCC(=O)NC1CC1c2ccccc2 Amb18983172 [0,0,0,1,0,1|2,0,0]=4 3169 B15R2.1621 NNC(=O)NC1CC1c2ccccc2 Amb19078521 [0,0,0,1,0,1|2,0,0]=4 3170 B15R2.1621 O=C(CBr)NC1CC1c2ccccc2 Amb24674725 [0,0,0,1,0,1|2,0,0]=4 3171 B15R2.1621 O=C(CCl)NC1CC1c2ccccc2 Amb24335576 [0,0,0,1,0,1|2,0,0]=4 3172 B15R2.1621 ONC(=O)NC1CC1c2ccccc2 Amb24453811 [0,0,0,1,0,1|2,0,0]=4 3173 B15R2.1995 COC1CC(C1)NCc2ccccc2 Amb25094640 [0,0,0,1,0,1|1,0,1]=4 3174 B15R2.4083 CC1C(CCC1=O)Cc2cc[n]cc2 Amb24433208 [0,0,0,1,0,1|2,0,0]=4 3175 B15R2.4083 CC1C(CCC1=O)Cc2ccccc2 Amb24714592 [0,0,0,1,0,1|1,0,0]=3 3176 B15R2.4083 CC1C(CCC1=O)Sc2cc[n]cc2 Amb24587703 [0,0,0,1,0,1|2,0,0]=4 3177 B15R2.4083 CC1C(CCC1=O)Sc2cccc[n]2 Amb24392545 [0,0,0,1,0,1|2,0,0]=4 3178 B15R2.4083 CC1N(CCC1=O)Cc2ccccc2 Amb17609111 [0,0,0,1,0,1|1,0,0]=3 3179 B15R2.4083 CN1C(Cc2ccccc2)CN=C1N Amb25679239 [0,0,0,1,0,1|2,0,0]=4 3180 B15R2.4083 CN1C(Cc2ccccc2)CNC1=O Amb18061674 [0,0,0,1,0,1|1,0,0]=3 3181 B15R2.4083 CN1C(Cc2ccccc2)COC1=O Amb18559293 [0,0,0,1,0,1|1,0,0]=3 3182 B15R2.4083 CN1[C@H](Cc2ccccc2)NCC1=O Amb25101554 [0,0,0,1,0,1|1,0,0]=3 3183 B15R2.4083 O=C1CCN(Cc2ccccc2)C1=O Amb19060341 [0,0,0,1,0,1|2,0,0]=4 3184 B15R2.4083 OC1C(COC1=O)Cc2ccccc2 Amb25266444 [0,0,0,1,0,1|2,0,0]=4 3185 B15R2.27836 C(OCCC1CCO1)c2ccccc2 Amb24517167 [0,0,0,1,0,1|1,0,1]=4 3186 B15R2.27836 C(OCC[C@H]1CCO1)c2ccccc2 Amb24663284 [0,0,0,1,0,1|1,0,1]=4 3187 B15R2.79185 C=CC(=O)NCC1Cc2ccccc21 Amb19059119 [0,0,0,1,0,1|1,0,1]=4 3188 B15R2.79185 CCC(=N)NCC1Cc2ccccc21 Amb25701261 [0,0,0,1,0,1|2,0,0]=4 3189 B15R2.79185 CCC(=O)NCC1Cc2ccccc21 Amb25725840 [0,0,0,1,0,1|1,0,0]=3 3190 B15R2.79185 CNC(=N)NCC1Cc2ccccc21 Amb19072433 [0,0,0,1,0,1|2,0,0]=4 3191 B15R2.79185 CNC(=O)CNC1Cc2ccccc21 Amb24403432 [0,0,0,1,0,1|1,0,0]=3 3192 B15R2.79185 CNC(=S)NCC1Cc2ccccc21 Amb24733026 [0,0,0,1,0,1|1,1,0]=4 3193 B15R2.79185 COC(=O)C#CC1Cc2ccccc21 Amb25775531 [0,0,0,1,0,1|0,0,1]=3 3194 B15R2.79185 COC(=O)NCC1Cc2ccccc21 Amb25115800 [0,0,0,1,0,1|0,0,0]=2 3195 B15R2.79185 NCC(=O)NCC1Cc2ccccc21 Amb18968593 [0,0,0,1,0,1|2,0,0]=4 3196 B15R2.79185 NNC(=O)NCC1Cc2ccccc21 Amb25291222 [0,0,0,1,0,1|2,0,0]=4 3197 B15R2.79185 O=C(CS)NCC1Cc2ccccc21 Amb25700281 [0,0,0,1,0,1|2,0,0]=4 3198 B15R2.79765 BrCC(=O)N1CCCc2c1cccc2 Amb17325849 [0,0,0,1,0,1|2,0,0]=4 3199 B15R2.79765 C#CC(=O)C1CCNc2ccccc21 Amb24763441 [0,0,0,1,0,1|1,0,1]=4 3200 B15R2.79765 C#CC(=O)C1CNCc2ccccc21 Amb25843634 [0,0,0,1,0,1|1,0,1]=4 3201 B15R2.79765 C=CC(=O)C1CNCc2ccccc21 Amb25819101 [0,0,0,1,0,1|1,0,1]=4 3202 B15R2.79765 CCC(=O)C1CCCc2ccc[n]c21 Amb25315921 [0,0,0,1,0,1|2,0,0]=4 3203 B15R2.79765 CCC(=O)C1CCCc2ccccc21 Amb19071757 [0,0,0,1,0,1|1,0,0]=3 3204 B15R2.79765 CCC(=O)C1CCNc2ccccc21 Amb24411202 [0,0,0,1,0,1|1,0,0]=3 3205 B15R2.79765 CCC(=O)C1CNCc2ccccc21 Amb25302608 [0,0,0,1,0,1|1,0,0]=3 3206 B15R2.79765 CCC(=O)C1NCCc2ccccc21 Amb24746407 [0,0,0,1,0,1|1,0,0]=3 3207 B15R2.79765 CCC(=O)C1OCCc2ccccc21 Amb25214209 [0,0,0,1,0,1|1,0,0]=3 3208 B15R2.79765 CCC(=O)N1CCOc2ccccc12 Amb18400325 [0,0,0,1,0,1|2,0,0]=4 3209 B15R2.79765 CCC(=O)N1CCSc2ccccc12 Amb24105095 [0,0,0,1,0,1|2,0,0]=4 3210 B15R2.79765 CNC(=N)N1CCCc2ccccc12 Amb19072431 [0,0,0,1,0,1|2,0,0]=4 3211 B15R2.79765 CNC(=O)C1CCNc2ccccc21 Amb23586317 [0,0,0,1,0,1|1,0,0]=3 3212 B15R2.79765 CNC(=O)C1CCOc2ccccc21 Amb24360134 [0,0,0,1,0,1|1,0,0]=3 3213 B15R2.79765 CNC(=O)C1CNCc2ccccc21 Amb18356848 [0,0,0,1,0,1|1,0,0]=3 3214 B15R2.79765 CNC(=O)C1NCCc2ccccc21 Amb18946032 [0,0,0,1,0,1|1,0,0]=3 3215 B15R2.79765 CNC(=O)C1SCCc2ccccc21 Amb22159780 [0,0,0,1,0,1|1,0,0]=3 3216 B15R2.79765 CNC(=O)N1CCCc2ccccc12 Amb22469712 [0,0,0,1,0,1|1,0,0]=3 3217 B15R2.79765 CNC(=O)N1CCSc2ccccc12 Amb24392178 [0,0,0,1,0,1|2,0,0]=4 3218 B15R2.79765 COC(=O)C1CCNc2c1cccc2 Amb10603355 [0,0,0,1,0,1|0,0,0]=2 3219 B15R2.79765 COC(=O)C1CNCc2c1cccc2 Amb10067661 [0,0,0,1,0,1|0,0,0]=2 3220 B15R2.79765 COC(=O)C1CNCc2c1cccc2 Amb15691942 [0,0,0,1,0,1|0,0,0]=2 3221 B15R2.79765 COC(=O)C1COCc2ccccc21 Amb24726066 [0,0,0,1,0,1|0,0,0]=2 3222 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb18956496 [0,0,0,1,0,1|0,0,0]=2 3223 B15R2.79765 COC(=O)C1NCCc2ccccc21 Amb19375544 [0,0,0,1,0,1|0,0,0]=2 3224 B15R2.79765 COC(=O)C1OCCc2c1cccc2 Amb1102553 [0,0,0,1,0,1|0,0,0]=2 3225 B15R2.79765 COC(=O)N1CCCc2c1cccc2 Amb1077839 [0,0,0,1,0,1|0,0,0]=2 3226 B15R2.79765 COC(=O)N1CCNc2ccccc12 Amb24552230 [0,0,0,1,0,1|1,0,0]=3 3227 B15R2.79765 COC(=O)[C@H]1CCNc2ccccc21 Amb24365240 [0,0,0,1,0,1|0,0,0]=2 3228 B15R2.79765 NCC(=O)N1CCCc2c1cccc2 Amb10610219 [0,0,0,1,0,1|2,0,0]=4 3229 B15R2.79765 NNC(=O)C1CCOc2ccccc21 Amb25251312 [0,0,0,1,0,1|2,0,0]=4 3230 B15R2.79765 NNC(=O)C1SCCc2ccccc21 Amb23504462 [0,0,0,1,0,1|2,0,0]=4 3231 B15R2.79765 O=C(CBr)C1CCOc2ccccc21 Amb24559718 [0,0,0,1,0,1|2,0,0]=4 3232 B15R2.79765 O=C(CS)N1CCCc2ccccc12 Amb20413874 [0,0,0,1,0,1|2,0,0]=4 3233 B15R2.79765 OCC(=O)N1CCCc2c1cccc2 Amb1110643 [0,0,0,1,0,1|2,0,0]=4 3234 B15R2.79765 ONC(=O)C1CCCc2ccccc21 Amb19073260 [0,0,0,1,0,1|2,0,0]=4 3235 B15R2.79765 ONC(=O)C1CNCc2ccccc21 Amb25684029 [0,0,0,1,0,1|2,0,0]=4 3236 B15R2.79765 ONC(=O)C1OCCc2ccccc21 Amb19050925 [0,0,0,1,0,1|2,0,0]=4 3237 B15R2.3 Cc1ccc(c[n]1)C2CCC(=O)CC2 Amb25186122 [0,1,0,1,0,0|2,0,0]=4 3238 B15R2.3 Cc1ccc(cc1)C2CCC(=O)CC2 Amb18066221 [0,1,0,1,0,0|1,0,0]=3 3239 B15R2.3 Cc1ccc(cc1)C2CNC(=O)CN2 Amb24345915 [0,1,0,1,0,0|2,0,0]=4 3240 B15R2.3 Cc1ccc(cc1)C2CNC(=O)CO2 Amb22643223 [0,1,0,1,0,0|2,0,0]=4 3241 B15R2.3 Nc1ccc([n]c1)C2CCC(=O)CC2 Amb25292304 [0,1,0,1,0,0|2,0,0]=4 3242 B15R2.3 Nc1ccc(c[n]1)C2CCC(=O)CC2 Amb25664322 [0,1,0,1,0,0|2,0,0]=4 3243 B15R2.3 Nc1ccc(cc1)C2CCC(=O)CC2 Amb25783916 [0,1,0,1,0,0|1,0,0]=3 3244 B15R2.3 Nc1ccc(cc1)C2CNC(=O)CC2 Amb24412884 [0,1,0,1,0,0|1,0,0]=3 3245 B15R2.3 Nc1ccc(cc1)C2CNC(=O)CO2 Amb18863707 [0,1,0,1,0,0|2,0,0]=4 3246 B15R2.3 Nc1ccc(cc1)C2CNC(=O)OC2 Amb18863710 [0,1,0,1,0,0|1,0,0]=3 3247 B15R2.3 O=C1CCC(CC1)C2=CNC(=O)C=C2 Amb25101908 [0,1,0,1,0,0|2,0,0]=4 3248 B15R2.3 O=C1CCC(CC1)c2ccc(Br)cc2 Amb18584294 [0,1,0,1,0,0|1,0,0]=3 3249 B15R2.3 O=C1CCC(CC1)c2ccc(F)[n]c2 Amb25329612 [0,1,0,1,0,0|2,0,0]=4 3250 B15R2.3 O=C1CCC(CC1)c2ccc(F)cc2 Amb18565089 [0,1,0,1,0,0|1,0,0]=3 3251 B15R2.3 O=C1CCC(CC1)c2ccc(cc2)Cl Amb15690968 [0,1,0,1,0,0|1,0,0]=3 3252 B15R2.3 O=C1CCC(CN1)c2ccc(cc2)Br Amb17414216 [0,1,0,1,0,0|1,0,0]=3 3253 B15R2.3 O=C1CCC(CN1)c2ccc(cc2)C Amb17401310 [0,1,0,1,0,0|1,0,0]=3 3254 B15R2.3 O=C1CCC(CN1)c2ccc(cc2)Cl Amb17403929 [0,1,0,1,0,0|1,0,0]=3 3255 B15R2.3 O=C1CCC(CN1)c2ccc(cc2)F Amb17401718 [0,1,0,1,0,0|1,0,0]=3 3256 B15R2.3 O=C1CCN(CC1)c2ccc(S)cc2 Amb25186281 [0,1,0,1,0,0|2,0,0]=4 3257 B15R2.3 O=C1CCN(CC1)c2ccc(cc2)N Amb17506931 [0,1,0,1,0,0|2,0,0]=4 3258 B15R2.3 O=C1CC[C@H](CN1)c2ccc(Br)cc2 Amb24613187 [0,1,0,1,0,0|1,0,0]=3 3259 B15R2.3 O=C1COC(CC1)c2ccc(Br)cc2 Amb24735207 [0,1,0,1,0,0|2,0,0]=4 3260 B15R2.3 O=C1COC(CN1)c2ccc(Br)cc2 Amb18878768 [0,1,0,1,0,0|2,0,0]=4 3261 B15R2.3 O=C1COC(CN1)c2ccc(F)cc2 Amb24088726 [0,1,0,1,0,0|2,0,0]=4 3262 B15R2.3 O=C1NCC(CN1)c2ccc(Br)cc2 Amb25056731 [0,1,0,1,0,0|2,0,0]=4 3263 B15R2.3 O=C1NCC(CN1)c2ccc(Cl)cc2 Amb25029055 [0,1,0,1,0,0|2,0,0]=4 3264 B15R2.3 O=C1NCC(CN1)c2ccc(F)cc2 Amb25048451 [0,1,0,1,0,0|2,0,0]=4 3265 B15R2.3 O=C1NCC(CO1)c2ccc(F)cc2 Amb24596161 [0,1,0,1,0,0|1,0,0]=3 3266 B15R2.3 Oc1ccc([n]c1)C2CCC(=O)CC2 Amb25092818 [0,1,0,1,0,0|2,0,0]=4 3267 B15R2.3 Oc1ccc(cc1)C2CNC(=O)CO2 Amb25162689 [0,1,0,1,0,0|2,0,0]=4 3268 B15R2.3 Oc1ccc(cc1)N2CCC(=O)CC2 Amb25085056 [0,1,0,1,0,0|2,0,0]=4 3269 B15R2.98 Cc1ccc(CC2CC(=O)CC2)cc1 Amb24683397 [0,1,0,1,0,0|1,0,0]=3 3270 B15R2.98 Cc1ccc(CC2CCC(=O)N2)cc1 Amb24468945 [0,1,0,1,0,0|2,0,0]=4 3271 B15R2.98 Cc1ccc(CC2CNC(=O)C2)cc1 Amb25738214 [0,1,0,1,0,0|1,0,0]=3 3272 B15R2.98 Cc1ccc(CC2CNC(=O)O2)cc1 Amb25035879 [0,1,0,1,0,0|2,0,0]=4 3273 B15R2.98 Cc1ccc(C[C@H]2COC(N)=N2)cc1 Amb24404825 [0,1,0,1,0,0|2,0,0]=4 3274 B15R2.98 Cc1ccc(cc1)SC2CC(=O)CC2 Amb25234536 [0,1,0,1,0,0|2,0,0]=4 3275 B15R2.98 NC1=NC(Cc2ccc(Cl)cc2)CO1 Amb24360401 [0,1,0,1,0,0|2,0,0]=4 3276 B15R2.98 Nc1ccc(CC2CCC(=O)N2)cc1 Amb18819188 [0,1,0,1,0,0|2,0,0]=4 3277 B15R2.98 Nc1ccc(CC2CCC(=O)O2)cc1 Amb24679101 [0,1,0,1,0,0|2,0,0]=4 3278 B15R2.98 Nc1ccc(CC2CNC(=O)O2)cc1 Amb18559562 [0,1,0,1,0,0|2,0,0]=4 3279 B15R2.98 Nc1ccc(C[C@@H]2COC(=O)N2)cc1 Amb19130394 [0,1,0,1,0,0|1,0,0]=3 3280 B15R2.98 O=C1C=C(CO1)Cc2ccc(Br)cc2 Amb24695815 [0,1,0,1,0,0|0,0,2]=4 3281 B15R2.98 O=C1CC(CC1)Nc2ccc(Cl)cc2 Amb24404895 [0,1,0,1,0,0|2,0,0]=4 3282 B15R2.98 O=C1CC(CC1)Oc2ccc(Cl)cc2 Amb25728344 [0,1,0,1,0,0|2,0,0]=4 3283 B15R2.98 O=C1CC(CC1)Oc2ccc(I)cc2 Amb25664430 [0,1,0,1,0,0|2,0,0]=4 3284 B15R2.98 O=C1CC(CC1)Sc2ccc(Br)cc2 Amb24703553 [0,1,0,1,0,0|2,0,0]=4 3285 B15R2.98 O=C1CC(CC1)Sc2ccc(Cl)cc2 Amb25818795 [0,1,0,1,0,0|2,0,0]=4 3286 B15R2.98 O=C1CC(CN1)CN2C=CC(=O)C=C2 Amb24717232 [0,1,0,1,0,0|2,0,0]=4 3287 B15R2.98 O=C1CC(Cc2ccc(Br)cc2)CC1 Amb25692749 [0,1,0,1,0,0|1,0,0]=3 3288 B15R2.98 O=C1CC(Cc2ccc(Cl)cc2)CC1 Amb24447923 [0,1,0,1,0,0|1,0,0]=3 3289 B15R2.98 O=C1CC(Cc2ccc(Cl)cc2)CN1 Amb24598310 [0,1,0,1,0,0|1,0,0]=3 3290 B15R2.98 O=C1CC(Cc2ccc(F)cc2)CC1 Amb25818479 [0,1,0,1,0,0|1,0,0]=3 3291 B15R2.98 O=C1CCC(Cc2ccc(Cl)cc2)N1 Amb25246668 [0,1,0,1,0,0|2,0,0]=4 3292 B15R2.98 O=C1CCC(Cc2ccc(F)cc2)N1 Amb25165817 [0,1,0,1,0,0|2,0,0]=4 3293 B15R2.98 O=C1CCC(Cc2ccc(I)cc2)N1 Amb24648527 [0,1,0,1,0,0|2,0,0]=4 3294 B15R2.98 O=C1CC[C@@H](Cc2ccc(Cl)cc2)N1 Amb25840376 [0,1,0,1,0,0|2,0,0]=4 3295 B15R2.98 O=C1CN(Cc2ccc(I)cc2)CC1 Amb24540206 [0,1,0,1,0,0|2,0,0]=4 3296 B15R2.98 Oc1ccc(CC2CCC(=O)O2)cc1 Amb20668221 [0,1,0,1,0,0|2,0,0]=4 3297 B15R2.98 Oc1ccc(cc1)SC2CC(=O)CC2 Amb25807541 [0,1,0,1,0,0|2,0,0]=4 3298 B15R2.98 Oc1ccc(cc1)S[C@H]2CC(=O)CC2 Amb25093657 [0,1,0,1,0,0|2,0,0]=4 3299 B15R2.275 COC1CCC(O1)c2ccc(I)cc2 Amb24090013 [0,1,0,1,0,0|0,0,2]=4 3300 B15R2.275 COC=1NCC(N1)c2ccc(Cl)cc2 Amb24592650 [0,1,0,1,0,0|2,0,0]=4 3301 B15R2.275 Cc1ccc(cc1)C2CCC(O2)OC Amb25315387 [0,1,0,1,0,0|0,0,2]=4 3302 B15R2.275 Cc1ccc(cc1)C2CNC(=N2)OC Amb25166131 [0,1,0,1,0,0|2,0,0]=4 3303 B15R2.1559 CCC(=O)C1CC1c2ccc(O)cc2 Amb25308950 [0,1,0,1,0,0|1,0,0]=3 3304 B15R2.1559 CNC(=O)C1OC1c2ccc(F)cc2 Amb25112129 [0,1,0,1,0,0|2,0,0]=4 3305 B15R2.1559 COC(=O)C1CC1c2ccc(F)cc2 Amb21926928 [0,1,0,1,0,0|0,0,0]=2 3306 B15R2.1559 COC(=O)C1OC1c2ccc(Br)cc2 Amb19930047 [0,1,0,1,0,0|1,0,0]=3 3307 B15R2.1559 COC(=O)C1OC1c2ccc(Cl)cc2 Amb19930052 [0,1,0,1,0,0|1,0,0]=3 3308 B15R2.1559 COC(=O)C1OC1c2ccc(F)cc2 Amb19930055 [0,1,0,1,0,0|1,0,0]=3 3309 B15R2.1559 COC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb25286593 [0,1,0,1,0,0|0,0,0]=2 3310 B15R2.1559 Cc1ccc(cc1)C2OC2C(=O)OC Amb19930060 [0,1,0,1,0,0|1,0,0]=3 3311 B15R2.1559 Cc1ccc(cc1)[C@@H]2O[C@H]2C(=O)NC Amb24512961 [0,1,0,1,0,0|2,0,0]=4 3312 B15R2.1559 NNC(=O)C1CC1c2ccc(cc2)C Amb1935117 [0,1,0,1,0,0|2,0,0]=4 3313 B15R2.1559 NNC(=O)C1CC1c2ccc(cc2)Cl Amb1935066 [0,1,0,1,0,0|2,0,0]=4 3314 B15R2.18933 CC1C(CCC1=O)c2ccc(O)cc2 Amb24364141 [0,1,0,1,0,0|1,0,0]=3 3315 B15R2.18933 CC1C(CNC1=O)c2ccc(N)cc2 Amb24373798 [0,1,0,1,0,0|2,0,0]=4 3316 B15R2.18933 CN1C(NCC1=O)c2ccc(Br)cc2 Amb24535900 [0,1,0,1,0,0|2,0,0]=4 3317 B15R2.18933 CN1C(NCC1=O)c2ccc(O)cc2 Amb25295722 [0,1,0,1,0,0|2,0,0]=4 3318 B15R2.18933 C[C@H]1[C@@H](CNC1=O)c2ccc(Cl)cc2 Amb25234672 [0,1,0,1,0,0|2,0,0]=4 3319 B15R2.50022 Brc1ccc2c(c1)N(C)C(=O)CCO2 Amb17573804 [0,1,0,1,0,0|2,0,0]=4 3320 B15R2.50022 CN1C(=O)CCNc2ccc(F)cc12 Amb19337048 [0,1,0,1,0,0|2,0,0]=4 3321 B15R2.50022 CN1C(=O)CCOc2ccc(O)cc12 Amb18894292 [0,1,0,1,0,0|2,0,0]=4 3322 B15R2.50022 CN1C(=O)CCOc2ccc(S)cc12 Amb25320526 [0,1,0,1,0,0|2,0,0]=4 3323 B15R2.50022 Cc1ccc2c(c1)N(C)C(=O)CCO2 Amb17570550 [0,1,0,1,0,0|2,0,0]=4 3324 B15R2.50022 Clc1ccc2c(c1)N(C)C(=O)CCO2 Amb17571354 [0,1,0,1,0,0|2,0,0]=4 3325 B15R2.50022 Clc1ccc2c(c1)N(C)C(=O)CCS2 Amb2407142 [0,1,0,1,0,0|2,0,0]=4 3326 B15R2.50022 Fc1ccc2c(c1)N(C)C(=O)CCO2 Amb17570727 [0,1,0,1,0,0|2,0,0]=4 3327 B15R2.50022 Nc1ccc2c(c1)N(C)C(=O)CCO2 Amb17570650 [0,1,0,1,0,0|2,0,0]=4 3328 B15R2.79417 CCC(=O)N1CCc2ccc(F)cc12 Amb25785342 [0,1,0,1,0,0|2,0,0]=4 3329 B15R2.79417 CNC(=O)N1CCc2ccc(F)cc12 Amb24369161 [0,1,0,1,0,0|2,0,0]=4 3330 B15R2.79417 CNC(=O)N1CCc2ccc(N)cc12 Amb25044621 [0,1,0,1,0,0|2,0,0]=4 3331 B15R2.79417 COC(=O)C1C=Nc2ccc(Br)cc21 Amb24053157 [0,1,0,1,0,0|1,0,1]=4 3332 B15R2.79417 COC(=O)C1CCc2ccc(Br)cc21 Amb21962689 [0,1,0,1,0,0|0,0,0]=2 3333 B15R2.79417 COC(=O)C1CCc2ccc(Cl)cc21 Amb22501000 [0,1,0,1,0,0|0,0,0]=2 3334 B15R2.79417 COC(=O)C1CCc2ccc(O)cc21 Amb22234429 [0,1,0,1,0,0|0,0,0]=2 3335 B15R2.79417 COC(=O)N1CCc2ccc(O)cc12 Amb25808799 [0,1,0,1,0,0|1,0,0]=3 3336 B15R2.81086 COC(=O)C[C@@H]1Cc2ccc(O)cc21 Amb24408314 [0,1,0,1,0,0|0,0,0]=2 3337 B15R2.1 C=NC1=CCC(CC1)c2ccccc2 Amb10601672 [0,1,0,1,0,0|2,0,0]=4 3338 B15R2.1 NN=C1CCC(CC1)c2ccccc2 Amb24678166 [0,1,0,1,0,0|2,0,0]=4 3339 B15R2.1 O=CC=1CCC(CC1)c2ccccc2 Amb24342731 [0,1,0,1,0,0|1,0,0]=3 3340 B15R2.1 O=CN1CCC(CC1)c2ccccc2 Amb22461861 [0,1,0,1,0,0|2,0,0]=4 3341 B15R2.1 O=C[C@@H]1CC[C@H](CC1)c2ccccc2 Amb25124799 [0,1,0,1,0,0|1,0,1]=4 3342 B15R2.1 O=NN1CCC(CC1)c2ccccc2 Amb25663908 [0,1,0,1,0,0|2,0,0]=4 3343 B15R2.1 [C-]#[N+]C=1CCC(CC1)c2ccccc2 Amb22265799 [0,1,0,1,0,0|2,0,0]=4 3344 B15R2.94 CC1CC(CCC1=O)c2ccccc2 Amb19077251 [0,1,0,1,0,0|1,0,0]=3 3345 B15R2.94 CC1CN(CCC1=O)c2ccccc2 Amb19060570 [0,1,0,1,0,0|2,0,0]=4 3346 B15R2.94 CN1CC(NCC1=O)c2ccccc2 Amb24397048 [0,1,0,1,0,0|2,0,0]=4 3347 B15R2.94 C[C@@H]1N[C@@H](CSC1=O)c2ccccc2 Amb24559185 [0,1,0,1,0,0|1,1,0]=4 3348 B15R2.94 NC1CC(CCC1=O)c2ccccc2 Amb18279407 [0,1,0,1,0,0|1,0,0]=3 3349 B15R2.94 NC1CC(CNC1=O)c2c[n]ccc2 Amb24721559 [0,1,0,1,0,0|2,0,0]=4 3350 B15R2.94 O=C1CC(CNC1=O)c2ccccc2 Amb25721865 [0,1,0,1,0,0|1,0,1]=4 3351 B15R2.94 O=C1CCC(CC1Br)c2ccccc2 Amb22263458 [0,1,0,1,0,0|1,0,0]=3 3352 B15R2.94 O=C1CCC(CC1Cl)c2ccccc2 Amb25670972 [0,1,0,1,0,0|1,0,0]=3 3353 B15R2.94 O=C1CC[C@H](C[C@H]1Cl)c2ccccc2 Amb24757743 [0,1,0,1,0,0|1,0,0]=3 3354 B15R2.94 O=C1NCC(CC1Cl)c2ccccc2 Amb25857457 [0,1,0,1,0,0|1,0,0]=3 3355 B15R2.94 O=C1OCC(NC1=O)c2ccccc2 Amb24393438 [0,1,0,1,0,0|1,0,1]=4 3356 B15R2.94 O=C1OC[C@@H](NC1=O)c2ccccc2 Amb25142013 [0,1,0,1,0,0|1,0,1]=4 3357 B15R2.94 O=C1OC[C@H](NC1=O)c2ccccc2 Amb25165721 [0,1,0,1,0,0|1,0,1]=4 3358 B15R2.94 O[C@H]1C[C@@H](CCC1=O)c2ccccc2 Amb24577030 [0,1,0,1,0,0|1,0,0]=3 3359 B15R2.96 CC1(CCC(=O)CC1)c2ccccc2 Amb22229848 [0,1,0,1,0,0|1,0,0]=3 3360 B15R2.96 CC1(CCC(=O)NC1)c2cccc[n]2 Amb24470798 [0,1,0,1,0,0|2,0,0]=4 3361 B15R2.96 CC1(CN=C(N)OC1)c2ccccc2 Amb25794219 [0,1,0,1,0,0|2,0,0]=4 3362 B15R2.96 CC1(CNC(=O)NC1)c2ccccc2 Amb22463650 [0,1,0,1,0,0|2,0,0]=4 3363 B15R2.96 C[C@@]1(CCC(=O)C=C1)c2ccccc2 Amb24567270 [0,1,0,1,0,0|1,0,1]=4 3364 B15R2.96 NC1(CCC(=O)CC1)c2ccccc2 Amb23589797 [0,1,0,1,0,0|1,0,0]=3 3365 B15R2.96 O=C1CCC(F)(CC1)c2ccc[n]c2 Amb25742385 [0,1,0,1,0,0|2,0,0]=4 3366 B15R2.96 O=C1CC[P+](CC1)(C)c2ccccc2 Amb16204177 [0,1,0,1,0,0|2,0,0]=4 3367 B15R2.96 OC1(CCC(=O)CC1)c2cc[n]cc2 Amb25771580 [0,1,0,1,0,0|2,0,0]=4 3368 B15R2.96 OC1(CCC(=O)CC1)c2cccc[n]2 Amb25314325 [0,1,0,1,0,0|2,0,0]=4 3369 B15R2.96 OC1(CCC(=O)CC1)c2ccccc2 Amb20248191 [0,1,0,1,0,0|1,0,0]=3 3370 B15R2.297 CC(C1CNC(=O)C1)c2ccccc2 Amb25067874 [0,1,0,1,0,0|1,0,0]=3 3371 B15R2.297 CC(C1CNC(=O)O1)c2ccccc2 Amb25037772 [0,1,0,1,0,0|2,0,0]=4 3372 B15R2.297 CC1CC(CO1)C(Br)c2ccccc2 Amb24462134 [0,1,0,1,0,0|1,0,1]=4 3373 B15R2.297 CC1CC(CO1)C(Cl)c2ccccc2 Amb25069969 [0,1,0,1,0,0|1,0,1]=4 3374 B15R2.297 CC1CC(CO1)C(N)c2ccccc2 Amb25167280 [0,1,0,1,0,0|1,0,1]=4 3375 B15R2.297 NC(C1CCC(=O)O1)c2ccccc2 Amb25036871 [0,1,0,1,0,0|2,0,0]=4 3376 B15R2.297 NC(C1COC(=O)N1)c2ccccc2 Amb24347364 [0,1,0,1,0,0|1,0,0]=3 3377 B15R2.297 O=C1CCC(N1)C(Cl)c2ccccc2 Amb24639054 [0,1,0,1,0,0|2,0,0]=4 3378 B15R2.297 O=C1CC[C@H](N1)[C@@H](Cl)c2ccccc2 Amb24520021 [0,1,0,1,0,0|2,0,0]=4 3379 B15R2.297 O=C1O[C@@H](CO1)[C@@H](Cl)c2ccccc2 Amb25317255 [0,1,0,1,0,0|1,0,0]=3 3380 B15R2.297 O=C1O[C@@H](CO1)[C@H](Cl)c2ccccc2 Amb24672562 [0,1,0,1,0,0|1,0,0]=3 3381 B15R2.297 OC(C1CCC(=O)N1)c2ccccc2 Amb25733120 [0,1,0,1,0,0|2,0,0]=4 3382 B15R2.297 OC(C1COC(=O)C1)c2ccccc2 Amb25803001 [0,1,0,1,0,0|0,0,0]=2 3383 B15R2.297 OC(C1COC(=O)N1)c2ccccc2 Amb24418449 [0,1,0,1,0,0|1,0,0]=3 3384 B15R2.297 OC(C1COC(=O)O1)c2ccccc2 Amb24718649 [0,1,0,1,0,0|1,0,0]=3 3385 B15R2.297 O[C@@H](C1CNC(=O)C1)c2ccccc2 Amb25747480 [0,1,0,1,0,0|1,0,0]=3 3386 B15R2.297 O[C@@H]([C@@H]1CCC(=O)O1)c2ccccc2 Amb24613504 [0,1,0,1,0,0|2,0,0]=4 3387 B15R2.297 O[C@@H]([C@H]1CCC(=O)O1)c2ccccc2 Amb24745880 [0,1,0,1,0,0|2,0,0]=4 3388 B15R2.297 O[C@H]([C@@H]1COC(=O)N1)c2ccccc2 Amb24513124 [0,1,0,1,0,0|1,0,0]=3 3389 B15R2.297 O[C@H]([C@H]1COC(=O)C1)c2ccccc2 Amb24719808 [0,1,0,1,0,0|0,0,0]=2 3390 B15R2.297 O[C@H]([C@H]1COC(=O)O1)c2ccccc2 Amb25215369 [0,1,0,1,0,0|1,0,0]=3 3391 B15R2.1130 O=C1OCC1NC(=O)c2ccccc2 Amb25165712 [0,1,0,1,0,0|1,0,1]=4 3392 B15R2.1596 COC(=O)C1CC(C1)c2ccccc2 Amb22284664 [0,1,0,1,0,0|0,0,0]=2 3393 B15R2.7221 CN1C(=O)CCC1(O)c2ccccc2 Amb2424191 [0,1,0,1,0,0|1,0,0]=3 3394 B15R2.7221 CN1C(=O)CNC1(C)c2ccccc2 Amb24573832 [0,1,0,1,0,0|2,0,0]=4 3395 B15R2.7340 CC1NCC(=O)N(C)c2ccccc21 Amb25801815 [0,1,0,1,0,0|2,0,0]=4 3396 B15R2.7343 CC=1CCC(O)c2ccccc2CC1 Amb25823116 [0,1,0,1,0,0|2,0,0]=4 3397 B15R2.19346 COC(=O)C1OC1(C)c2ccccc2 Amb24066728 [0,1,0,1,0,0|1,0,0]=3 3398 B15R2.19515 COC(=O)\C=C/1\C(O)c2ccccc12 Amb25057734 [0,1,0,1,0,0|0,0,2]=4 3399 B15R2.23388 CC1CC(C(=O)CC)c2ccccc21 Amb25367135 [0,1,0,1,0,0|1,0,0]=3 3400 B15R2.23388 CN(OC)C1CC(N)c2ccccc21 Amb24649424 [0,1,0,1,0,0|2,0,0]=4 3401 B15R2.23388 CNC(=O)C1CC(=O)c2c1cccc2 Amb17470705 [0,1,0,1,0,0|1,0,1]=4 3402 B15R2.23388 COC(=O)C1CC(=O)c2ccccc12 Amb17755304 [0,1,0,1,0,0|0,0,1]=3 3403 B15R2.23388 COC(=O)C1CC(N)c2ccccc21 Amb18650818 [0,1,0,1,0,0|0,0,0]=2 3404 B15R2.23388 COC(=O)C1CC(O)c2ccccc21 Amb25813835 [0,1,0,1,0,0|0,0,0]=2 3405 B15R2.23388 COC(=O)C1OC(O)c2ccccc21 Amb25215821 [0,1,0,1,0,0|1,0,0]=3 3406 B15R2.23388 COC(=O)[C@@H]1C[C@H](N)c2ccccc21 Amb24512057 [0,1,0,1,0,0|0,0,0]=2 3407 B15R2.23388 COC(=O)[C@H]1C[C@@H](N)c2ccccc21 Amb24621274 [0,1,0,1,0,0|0,0,0]=2 3408 B15R2.5228 O=CC1(COCc2ccccc2)CO1 Amb24680212 [0,1,0,1,0,0|1,0,1]=4 3409 B15R2.31 C=C1CC(Cc2ccccc2)NCC1 Amb18649678 [0,1,0,1,0,0|2,0,0]=4 3410 B15R2.31 O=C1C=CC[C@H](Cc2ccccc2)O1 Amb24499879 [0,1,0,1,0,0|2,0,0]=4 3411 B15R2.31 O=C1CC(CCC1)Sc2ccccc2 Amb25123623 [0,1,0,1,0,0|2,0,0]=4 3412 B15R2.31 O=C1CC(Cc2cc[n]cc2)CCC1 Amb24752521 [0,1,0,1,0,0|2,0,0]=4 3413 B15R2.31 O=C1CC(Cc2ccc[n]c2)CCC1 Amb24645957 [0,1,0,1,0,0|2,0,0]=4 3414 B15R2.31 O=C1CC(Cc2cccc[n]2)CCC1 Amb25059804 [0,1,0,1,0,0|2,0,0]=4 3415 B15R2.31 O=C1CC(Cc2ccccc2)CCC1 Amb21959248 [0,1,0,1,0,0|1,0,0]=3 3416 B15R2.31 O=C1CC(Cc2ccccc2)CCN1 Amb25835625 [0,1,0,1,0,0|1,0,0]=3 3417 B15R2.31 O=C1CC(Cc2ccccc2)NCC1 Amb22235280 [0,1,0,1,0,0|1,0,0]=3 3418 B15R2.31 O=C1CC(Cc2ccccc2)OC=C1 Amb24679586 [0,1,0,1,0,0|1,0,1]=4 3419 B15R2.31 O=C1CCSC(Cc2ccccc2)N1 Amb24375776 [0,1,0,1,0,0|2,0,0]=4 3420 B15R2.31 O=C1CN(Cc2ccccc2)CCO1 Amb22490281 [0,1,0,1,0,0|1,0,0]=3 3421 B15R2.31 O=C1CNC[C@H](Cc2ccccc2)N1 Amb25791537 [0,1,0,1,0,0|2,0,0]=4 3422 B15R2.31 O=C1COCC(Cc2ccccc2)N1 Amb21864802 [0,1,0,1,0,0|1,0,0]=3 3423 B15R2.31 O=C1COC[C@@H](Cc2ccccc2)N1 Amb25082881 [0,1,0,1,0,0|1,0,0]=3 3424 B15R2.31 O=C1COC[C@H](Cc2ccccc2)N1 Amb25725966 [0,1,0,1,0,0|1,0,0]=3 3425 B15R2.31 O=C1CSCC(Cc2ccccc2)N1 Amb25090892 [0,1,0,1,0,0|1,1,0]=4 3426 B15R2.31 O=C1CSC[C@@H](Cc2ccccc2)N1 Amb25267532 [0,1,0,1,0,0|1,1,0]=4 3427 B15R2.31 O=C1C[C@@H](Cc2ccccc2)NCC1 Amb25244167 [0,1,0,1,0,0|1,0,0]=3 3428 B15R2.31 O=C1C[C@H](Cc2ccccc2)NCC1 Amb24554093 [0,1,0,1,0,0|1,0,0]=3 3429 B15R2.31 O=C1NC(Cc2ccccc2)CCN1 Amb25081057 [0,1,0,1,0,0|2,0,0]=4 3430 B15R2.31 O=S1CC(Cc2ccccc2)NCC1 Amb25814941 [0,1,0,1,0,0|2,0,0]=4 3431 B15R2.31 S=C1CC(Cc2ccccc2)CCN1 Amb25165996 [0,1,0,1,0,0|1,1,0]=4 3432 B15R2.55 O=C1CCCC1CCc2cc[n]cc2 Amb25823679 [0,1,0,1,0,0|2,0,0]=4 3433 B15R2.55 O=C1CCCC1CCc2ccc[n]c2 Amb24732395 [0,1,0,1,0,0|2,0,0]=4 3434 B15R2.55 O=C1CCCC1CNc2ccccc2 Amb25301253 [0,1,0,1,0,0|2,0,0]=4 3435 B15R2.55 O=C1CCNC1CCc2ccccc2 Amb25084380 [0,1,0,1,0,0|1,0,0]=3 3436 B15R2.55 O=C1COCC1OCc2ccccc2 Amb25229263 [0,1,0,1,0,0|1,0,0]=3 3437 B15R2.55 O=C1CSCC1CCc2cc[n]cc2 Amb24431354 [0,1,0,1,0,0|1,1,0]=4 3438 B15R2.55 O=C1CSCC1CCc2ccccc2 Amb24531970 [0,1,0,1,0,0|0,1,0]=3 3439 B15R2.55 O=C1NCCC1CCc2ccccc2 Amb25227286 [0,1,0,1,0,0|1,0,0]=3 3440 B15R2.55 O=C1NCCC1NCc2ccccc2 Amb25307498 [0,1,0,1,0,0|2,0,0]=4 3441 B15R2.55 O=C1NOCC1NCc2cc[n]cc2 Amb24709508 [0,1,0,1,0,0|2,0,0]=4 3442 B15R2.55 O=C1NOCC1NCc2ccc[n]c2 Amb25299679 [0,1,0,1,0,0|2,0,0]=4 3443 B15R2.55 O=C1OCC=C1CNc2ccccc2 Amb25664197 [0,1,0,1,0,0|1,0,1]=4 3444 B15R2.73 BrCCC(=O)N1CCc2c1cccc2 Amb17332660 [0,1,0,1,0,0|2,0,0]=4 3445 B15R2.73 C=CCC(=O)C1CCc2ccccc21 Amb25305030 [0,1,0,1,0,0|1,0,1]=4 3446 B15R2.73 CCCC(=O)C1CCc2ccc[n]c21 Amb25213870 [0,1,0,1,0,0|2,0,0]=4 3447 B15R2.73 CCCC(=O)C1CCc2ccccc21 Amb24591977 [0,1,0,1,0,0|1,0,0]=3 3448 B15R2.73 CCCC(=O)C1CSc2ccccc21 Amb24499858 [0,1,0,1,0,0|2,0,0]=4 3449 B15R2.73 CCNC(=N)C1CCc2ccccc21 Amb25814814 [0,1,0,1,0,0|2,0,0]=4 3450 B15R2.73 CCNC(=O)C1COc2ccccc21 Amb24335931 [0,1,0,1,0,0|2,0,0]=4 3451 B15R2.73 CCOC(=N)C1CCc2ccccc21 Amb25762273 [0,1,0,1,0,0|1,0,0]=3 3452 B15R2.73 CCOC(=O)C1=NCc2c1cccc2 Amb16237309 [0,1,0,1,0,0|1,0,1]=4 3453 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb22276114 [0,1,0,1,0,0|1,0,0]=3 3454 B15R2.73 CCOC(=O)C1CNc2ccccc21 Amb25775070 [0,1,0,1,0,0|1,0,0]=3 3455 B15R2.73 CCOC(=O)C1COc2ccccc21 Amb22059418 [0,1,0,1,0,0|1,0,0]=3 3456 B15R2.73 CCOC(=O)C1NCc2ccccc21 Amb22750001 [0,1,0,1,0,0|1,0,0]=3 3457 B15R2.73 CCOC(=O)[C@@H]1CNc2ccccc21 Amb22744934 [0,1,0,1,0,0|1,0,0]=3 3458 B15R2.73 CNCC(=O)N1CCc2c1cccc2 Amb2275648 [0,1,0,1,0,0|2,0,0]=4 3459 B15R2.73 CNCC(=O)N1CCc2ccccc12 Amb17712322 [0,1,0,1,0,0|2,0,0]=4 3460 B15R2.73 COCC(=O)C1CCc2ccc[n]c21 Amb24386454 [0,1,0,1,0,0|1,0,0]=3 3461 B15R2.73 COCC(=O)C1CNc2ccccc21 Amb25819264 [0,1,0,1,0,0|1,0,0]=3 3462 B15R2.73 ClCCC(=O)N1CCc2c1cccc2 Amb1106290 [0,1,0,1,0,0|2,0,0]=4 3463 B15R2.73 NCCC(=O)C1NCc2ccccc21 Amb24573658 [0,1,0,1,0,0|2,0,0]=4 3464 B15R2.73 NCCC(=O)N1CCc2c1cccc2 Amb1133951 [0,1,0,1,0,0|2,0,0]=4 3465 B15R2.73 NCCC(=O)N1CCc2c1cccc2 Amb15741007 [0,1,0,1,0,0|2,0,0]=4 3466 B15R2.73 O=C(CCS)N1CCc2ccccc12 Amb25136124 [0,1,0,1,0,0|2,0,0]=4 3467 B15R2.73 OCCC(=O)C1CCc2ccccc21 Amb24353053 [0,1,0,1,0,0|1,0,0]=3 3468 B15R2.73 OCCC(=O)N1CCc2c1cccc2 Amb17336306 [0,1,0,1,0,0|2,0,0]=4 3469 B15R2.132 CCC1C(Cc2ccccc2)NC1=O Amb25251140 [0,1,0,1,0,0|2,0,0]=4 3470 B15R2.132 CC[C@H]1[C@H](Cc2ccccc2)NC1=O Amb24512969 [0,1,0,1,0,0|2,0,0]=4 3471 B15R2.132 OCN1[C@@H](Cc2ccccc2)CC1=O Amb25198072 [0,1,0,1,0,0|1,0,0]=3 3472 B15R2.132 OCN1[C@H](Cc2ccccc2)CC1=O Amb24384401 [0,1,0,1,0,0|1,0,0]=3 3473 B15R2.236 CCN1C(=O)CCCc2c1cccc2 Amb2410514 [0,1,0,1,0,0|1,0,0]=3 3474 B15R2.236 O=C1CCCc2ccccc2C1C=O Amb24336749 [0,1,0,1,0,0|1,0,1]=4 3475 B15R2.325 CC1=CC(=O)CC1Cc2ccccc2 Amb25070652 [0,1,0,1,0,0|1,0,0]=3 3476 B15R2.325 CC1CC(=O)CN1Cc2ccccc2 Amb20668026 [0,1,0,1,0,0|2,0,0]=4 3477 B15R2.325 CC1NC(=O)CC1Cc2ccccc2 Amb24408674 [0,1,0,1,0,0|1,0,0]=3 3478 B15R2.325 CC1OC(=O)CC1Sc2ccccc2 Amb25778052 [0,1,0,1,0,0|1,0,0]=3 3479 B15R2.325 CC1OC(=O)NC1Cc2ccccc2 Amb25840945 [0,1,0,1,0,0|1,0,0]=3 3480 B15R2.325 C[C@@H]1CC(=O)N[C@H]1Cc2ccccc2 Amb24512786 [0,1,0,1,0,0|2,0,0]=4 3481 B15R2.325 C[C@@H]1OC(N)=N[C@H]1Cc2ccccc2 Amb25179225 [0,1,0,1,0,0|2,0,0]=4 3482 B15R2.325 C[C@H]1CC(=O)N[C@@H]1Cc2ccccc2 Amb24674270 [0,1,0,1,0,0|2,0,0]=4 3483 B15R2.325 C[C@H]1OC(N)=N[C@H]1Cc2ccccc2 Amb25179226 [0,1,0,1,0,0|2,0,0]=4 3484 B15R2.325 NC1CC(=O)NC1Cc2ccccc2 Amb24447076 [0,1,0,1,0,0|2,0,0]=4 3485 B15R2.325 O=C1CC(Cc2c[n]ccc2)C(=O)O1 Amb19108564 [0,1,0,1,0,0|1,0,1]=4 3486 B15R2.325 O=C1CC(Cc2cc[n]cc2)C(=O)O1 Amb19108565 [0,1,0,1,0,0|1,0,1]=4 3487 B15R2.325 O=C1CC(Cc2cccc[n]2)C(=O)O1 Amb19108563 [0,1,0,1,0,0|1,0,1]=4 3488 B15R2.325 O=C1C[C@H](Cc2ccccc2)C(=O)O1 Amb22226487 [0,1,0,1,0,0|0,0,1]=3 3489 B15R2.325 O=C1NC(=O)CC1Cc2ccccc2 Amb17470703 [0,1,0,1,0,0|1,0,1]=4 3490 B15R2.325 O=C1OC(=O)NC1Cc2ccccc2 Amb22496991 [0,1,0,1,0,0|1,0,1]=4 3491 B15R2.325 O[C@@H]1CC(=O)N[C@@H]1Cc2ccccc2 Amb25216204 [0,1,0,1,0,0|2,0,0]=4 3492 B15R2.325 O[C@@H]1CC(=O)N[C@H]1Cc2ccccc2 Amb24666708 [0,1,0,1,0,0|2,0,0]=4 3493 B15R2.325 O[C@H]1CC(=O)N[C@@H]1Cc2ccccc2 Amb24513129 [0,1,0,1,0,0|2,0,0]=4 3494 B15R2.325 O[C@H]1CC(=O)O[C@@H]1Cc2ccccc2 Amb24622523 [0,1,0,1,0,0|2,0,0]=4 3495 B15R2.389 CC1CC(=O)CCN1c2ccccc2 Amb19060571 [0,1,0,1,0,0|2,0,0]=4 3496 B15R2.389 CC=1CCC(C(Cl)C1)c2ccccc2 Amb24757642 [0,1,0,1,0,0|2,0,0]=4 3497 B15R2.389 CC=1NC(=O)CCC1c2ccccc2 Amb21951676 [0,1,0,1,0,0|1,0,1]=4 3498 B15R2.389 CN1CC(=O)NCC1c2ccccc2 Amb24066170 [0,1,0,1,0,0|2,0,0]=4 3499 B15R2.389 C[C@@H]1CC(=O)NC[C@H]1c2ccccc2 Amb25357600 [0,1,0,1,0,0|1,0,0]=3 3500 B15R2.389 C[C@@H]1NC(=O)CO[C@H]1c2ccccc2 Amb24356808 [0,1,0,1,0,0|2,0,0]=4 3501 B15R2.389 O=C1CC(=O)NCC1c2ccccc2 Amb25835672 [0,1,0,1,0,0|1,0,1]=4 3502 B15R2.389 O=C1CC(Br)C(NN1)c2ccccc2 Amb24702561 [0,1,0,1,0,0|2,0,0]=4 3503 B15R2.389 O=C1CCC(c2cc[n]cc2)C(=O)O1 Amb25850205 [0,1,0,1,0,0|1,0,1]=4 3504 B15R2.389 O=C1NC(=O)CCC1c2ccccc2 Amb17470704 [0,1,0,1,0,0|1,0,1]=4 3505 B15R2.389 O=C1OC(=O)NCC1c2ccccc2 Amb25803645 [0,1,0,1,0,0|1,0,1]=4 3506 B15R2.389 OC1NC(=O)OCC1c2ccccc2 Amb25075577 [0,1,0,1,0,0|1,0,0]=3 3507 B15R2.389 [O-][N+]1=CC(=O)OC[C@H]1c2ccccc2 Amb24733563 [0,1,0,1,0,0|1,0,1]=4 3508 B15R2.538 O=C1CCOc2cc(CCN1)ccc2 Amb25690242 [0,1,0,1,0,0|2,0,0]=4 3509 B15R2.1151 CC1NC(=O)C1OCc2ccccc2 Amb25132249 [0,1,0,1,0,0|2,0,0]=4 3510 B15R2.1291 CCOC1=Nc2ccccc2CCC1 Amb10811901 [0,1,0,1,0,0|1,0,0]=3 3511 B15R2.1291 CCOC=1NCCc2ccccc2N1 Amb25756153 [0,1,0,1,0,0|2,0,0]=4 3512 B15R2.1342 C#CCC(=O)C1CC1c2ccccc2 Amb24429642 [0,1,0,1,0,0|1,0,1]=4 3513 B15R2.1342 CCNC(=O)C1CC1c2ccccc2 Amb17785739 [0,1,0,1,0,0|1,0,0]=3 3514 B15R2.1342 CCNC(=O)C1OC1c2ccccc2 Amb25758014 [0,1,0,1,0,0|2,0,0]=4 3515 B15R2.1342 CCNC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb25271539 [0,1,0,1,0,0|1,0,0]=3 3516 B15R2.1342 CCNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25286590 [0,1,0,1,0,0|1,0,0]=3 3517 B15R2.1342 CCNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24561014 [0,1,0,1,0,0|2,0,0]=4 3518 B15R2.1342 CCOC(=O)C1CC1c2c[n]ccc2 Amb22000947 [0,1,0,1,0,0|1,0,0]=3 3519 B15R2.1342 CCOC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb10075604 [0,1,0,1,0,0|0,0,0]=2 3520 B15R2.1342 CCOC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080019 [0,1,0,1,0,0|1,0,0]=3 3521 B15R2.1342 CONC(=O)C1CC1c2ccccc2 Amb16988981 [0,1,0,1,0,0|0,0,0]=2 3522 B15R2.1342 N#CCC(=O)C1CC1c2ccccc2 Amb25840685 [0,1,0,1,0,0|1,0,1]=4 3523 B15R2.1342 O=C(N=C=O)C1CC1c2ccccc2 Amb25169885 [0,1,0,1,0,0|1,0,1]=4 3524 B15R2.1342 O=C(N=C=S)C1CC1c2ccccc2 Amb24499251 [0,1,0,1,0,0|1,0,1]=4 3525 B15R2.1342 [N-]=[N+]=NC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939353 [0,1,0,1,0,0|2,0,0]=4 3526 B15R2.2196 C(CNC1=NCCO1)c2ccccc2 Amb25289198 [0,1,0,1,0,0|2,0,0]=4 3527 B15R2.2349 CCN1C(=O)CCC1c2cccnc2 Amb17614139 [0,1,0,1,0,0|2,0,0]=4 3528 B15R2.2349 CCN1C(SCC1=O)c2ccccc2 Amb24511052 [0,1,0,1,0,0|2,0,0]=4 3529 B15R2.2349 CNC1C(CNC1=O)c2ccccc2 Amb24428611 [0,1,0,1,0,0|2,0,0]=4 3530 B15R2.2349 COC=1C(=O)NCC1c2ccccc2 Amb25835172 [0,1,0,1,0,0|1,0,1]=4 3531 B15R2.2349 CON1C(O)CCC1c2ccccc2 Amb25120095 [0,1,0,1,0,0|0,0,2]=4 3532 B15R2.2349 CON1C(O)CC[C@H]1c2ccccc2 Amb25787377 [0,1,0,1,0,0|0,0,2]=4 3533 B15R2.2349 OCC1C(CCC1=O)c2ccccc2 Amb24719606 [0,1,0,1,0,0|1,0,0]=3 3534 B15R2.2349 OCC=1C(=O)CCC1c2ccccc2 Amb25332345 [0,1,0,1,0,0|1,0,1]=4 3535 B15R2.2349 OCN1C(=O)CCN1c2ccccc2 Amb24431856 [0,1,0,1,0,0|2,0,0]=4 3536 B15R2.2349 OCN1C(CCC1=O)c2ccc[n]c2 Amb25680647 [0,1,0,1,0,0|2,0,0]=4 3537 B15R2.2349 OCN1C(COC1=O)c2ccccc2 Amb24576951 [0,1,0,1,0,0|2,0,0]=4 3538 B15R2.2349 OCN1[C@@H](COC1=O)c2ccccc2 Amb24688296 [0,1,0,1,0,0|2,0,0]=4 3539 B15R2.8625 O=C1CCNc2ccccc2CCN1 Amb25823734 [0,1,0,1,0,0|2,0,0]=4 3540 B15R2.16438 O=C(C1CC1)NCCc2ccccc2 Amb2422381 [0,1,0,1,0,0|2,0,0]=4 3541 B15R2.1190 C\N=C(\OC)/C1CC1c2ccccc2 Amb22356823 [0,1,0,1,0,0|1,0,0]=3 3542 B15R2.1899 C\C=C/1\CN(Cc2ccccc2)C1=O Amb24539780 [0,1,0,1,0,0|2,0,0]=4 3543 B15R2.2284 CC=1c2ccccc2OCCC1C=O Amb24456621 [0,1,0,1,0,0|2,0,0]=4 3544 B15R2.2284 CCC1CCCc2ccccc2C1=O Amb19071735 [0,1,0,1,0,0|1,0,1]=4 3545 B15R2.2284 CCN1CCCc2ccccc2C1=O Amb25820709 [0,1,0,1,0,0|2,0,0]=4 3546 B15R2.2284 CNC1CCCc2ccccc2C1=O Amb25732916 [0,1,0,1,0,0|1,0,1]=4 3547 B15R2.2284 COC1CCCc2c(C1N)cccc2 Amb1131637 [0,1,0,1,0,0|1,0,1]=4 3548 B15R2.2284 COC1CCCc2ccccc2C1O Amb19078935 [0,1,0,1,0,0|0,0,2]=4 3549 B15R2.2284 [O-]\C=C/1\CCCc2ccccc2C1=O Amb24707502 [0,1,0,1,0,0|2,0,0]=4 3550 B15R2.33687 CCC1(CCCc2ccccc12)C=O Amb25697246 [0,1,0,1,0,0|1,0,1]=4 3551 B15R2.33687 COC1(CCCc2ccccc12)C#N Amb24412408 [0,1,0,1,0,0|1,0,1]=4 3552 B15R2.33687 COC1(CCCc2ccccc12)OC Amb25173977 [0,1,0,1,0,0|0,0,2]=4 3553 B15R2.33687 COC1(CCOc2ccccc12)C=O Amb25161890 [0,1,0,1,0,0|1,0,1]=4 3554 B15R2.33687 COC1(CN)CCCc2ccccc12 Amb18910168 [0,1,0,1,0,0|1,0,1]=4 3555 B15R2.33687 COC1(COCc2ccccc12)C=O Amb25299870 [0,1,0,1,0,0|1,0,1]=4 3556 B15R2.314 CC1=CC(Cc2ccccc2)NC1=O Amb25035893 [0,1,0,1,0,0|2,0,0]=4 3557 B15R2.314 CC1CC(Cc2ccccc2)NC1=O Amb24071052 [0,1,0,1,0,0|2,0,0]=4 3558 B15R2.314 CC1CN(Cc2ccccc2)CC1=O Amb20622818 [0,1,0,1,0,0|2,0,0]=4 3559 B15R2.314 CN1CC(Cc2ccccc2)OC1=O Amb18559294 [0,1,0,1,0,0|2,0,0]=4 3560 B15R2.314 CN1C[C@H](Cc2ccccc2)NC1=O Amb24717368 [0,1,0,1,0,0|2,0,0]=4 3561 B15R2.314 C[C@@H]1C[C@H](Cc2ccccc2)NC1=O Amb24555628 [0,1,0,1,0,0|2,0,0]=4 3562 B15R2.314 NC1CN(Cc2ccccc2)CC1=O Amb25253746 [0,1,0,1,0,0|2,0,0]=4 3563 B15R2.314 O[C@H]1C[C@@H](Cc2ccccc2)OC1=O Amb24675457 [0,1,0,1,0,0|2,0,0]=4 3564 B15R2.323 CC1C(C(O)CC1=O)c2ccccc2 Amb25680549 [0,1,0,1,0,0|1,0,0]=3 3565 B15R2.323 CN1C(C(Cl)CC1=O)c2ccc[n]c2 Amb25041153 [0,1,0,1,0,0|2,0,0]=4 3566 B15R2.323 NC1CC(=O)N(C1c2ccccc2)C Amb17516995 [0,1,0,1,0,0|1,0,0]=3 3567 B15R2.323 NC1CC(=O)N(C1c2ccccn2)C Amb17517040 [0,1,0,1,0,0|2,0,0]=4 3568 B15R2.323 NC1CC(=O)N(C1c2cccnc2)C Amb17517041 [0,1,0,1,0,0|2,0,0]=4 3569 B15R2.323 NC1CC(=O)N(C1c2ccncc2)C Amb17517042 [0,1,0,1,0,0|2,0,0]=4 3570 B15R2.1157 O=C1CC(=O)Nc2ccccc2CO1 Amb25824720 [0,1,0,1,0,0|1,0,1]=4 3571 B15R2.1569 CCC(=O)CN1Cc2ccccc2C1 Amb19077881 [0,1,0,1,0,0|2,0,0]=4 3572 B15R2.1569 CCC(=O)NC1Cc2c(C1)cccc2 Amb2031412 [0,1,0,1,0,0|2,0,0]=4 3573 B15R2.1569 CNC(=O)NC1Cc2ccccc2C1 Amb22584235 [0,1,0,1,0,0|2,0,0]=4 3574 B15R2.1569 COC(=O)C=C1Cc2ccccc2C1 Amb25138575 [0,1,0,1,0,0|0,0,2]=4 3575 B15R2.1569 COC(=O)CC1Cc2ccccc2C1 Amb21964299 [0,1,0,1,0,0|0,0,0]=2 3576 B15R2.1569 COC(=O)Cc1[n]c2ccccc2o1 Amb22755647 [0,1,0,1,0,0|1,0,1]=4 3577 B15R2.1569 COC(=O)Cc1cc2ccccc2[nH]1 Amb20621456 [0,1,0,1,0,0|0,0,2]=4 3578 B15R2.1569 COC(=O)Cc1cc2ccccc2o1 Amb22234811 [0,1,0,1,0,0|0,0,2]=4 3579 B15R2.1569 COC(=O)Cc1nc2c([nH]1)cccc2 Amb1104664 [0,1,0,1,0,0|1,0,1]=4 3580 B15R2.1569 COC(=O)Cc1nc2c([nH]1)cccc2 Amb2249201 [0,1,0,1,0,0|1,0,1]=4 3581 B15R2.1569 COC(=O)Cn1nc2c(n1)cccc2 Amb10569882 [0,1,0,1,0,0|2,0,0]=4 3582 B15R2.1569 COC(=O)\C=C/1\Cc2ccccc2N1 Amb24548269 [0,1,0,1,0,0|0,0,2]=4 3583 B15R2.1569 CON(C)C[C@@H]1Cc2ccccc2N1 Amb25819603 [0,1,0,1,0,0|2,0,0]=4 3584 B15R2.1569 NOC(=O)CC1Cc2ccccc2C1 Amb25797243 [0,1,0,1,0,0|1,0,0]=3 3585 B15R2.4086 CC1(CO[C@H](O)C1)Cc2ccccc2 Amb25077936 [0,1,0,1,0,0|0,0,2]=4 3586 B15R2.4086 CC1(Cc2cccc[n]2)CCC(=O)C1 Amb25857604 [0,1,0,1,0,0|2,0,0]=4 3587 B15R2.4086 CC1(Cc2ccccc2)CCC(=O)C1 Amb24420339 [0,1,0,1,0,0|1,0,0]=3 3588 B15R2.4086 CC=1CC(N)(Cc2ccccc2)CC1 Amb25765731 [0,1,0,1,0,0|2,0,0]=4 3589 B15R2.4086 OC1(Cc2ccccc2)CCC(=O)N1 Amb24410101 [0,1,0,1,0,0|2,0,0]=4 3590 B15R2.8448 CC1CC(=O)N(C)c2ccccc2N1 Amb19337762 [0,1,0,1,0,0|2,0,0]=4 3591 B15R2.8448 CC1CC(=O)N(c2c(O1)cccc2)C Amb17570542 [0,1,0,1,0,0|2,0,0]=4 3592 B15R2.19393 CCC(=O)N1C(C)Cc2ccccc12 Amb23213532 [0,1,0,1,0,0|2,0,0]=4 3593 B15R2.19393 CNC(=O)N1C(C)Cc2ccccc12 Amb24374752 [0,1,0,1,0,0|2,0,0]=4 3594 B15R2.19393 COC(=O)C1C(N)Cc2ccc[n]c21 Amb25269500 [0,1,0,1,0,0|1,0,0]=3 3595 B15R2.19393 COC(=O)C1C(O)Cc2ccc[n]c21 Amb24352204 [0,1,0,1,0,0|1,0,0]=3 3596 B15R2.19393 COC(=O)C1C(O)Cc2ccccc21 Amb25813762 [0,1,0,1,0,0|0,0,0]=2 3597 B15R2.19393 COC(=O)C1c2ccccc2CC1=O Amb21964401 [0,1,0,1,0,0|0,0,1]=3 3598 B15R2.19393 COC(=O)C1c2ccccc2NC1=O Amb25770602 [0,1,0,1,0,0|1,0,1]=4 3599 B15R2.19393 COC(=O)[C@@H]1[C@H](O)Cc2ccccc21 Amb25221513 [0,1,0,1,0,0|0,0,0]=2 3600 B15R2.19393 COC(=O)[C@H]1[C@@H](O)Cc2ccc[n]c21 Amb25234740 [0,1,0,1,0,0|1,0,0]=3 3601 B15R2.19393 COC(=O)[C@H]1[C@@H](O)Cc2ccccc21 Amb24713673 [0,1,0,1,0,0|0,0,0]=2 3602 B15R2.321 CC1CC(=C(C1=O)C)c2ccccc2 Amb17594832 [0,1,0,1,0,0|1,0,1]=4 3603 B15R2.321 CC1NC(c2ccccc2)N(C)C1=O Amb25665765 [0,1,0,1,0,0|2,0,0]=4 3604 B15R2.321 CN1C(CC(Cl)C1=O)c2ccc[n]c2 Amb25743441 [0,1,0,1,0,0|2,0,0]=4 3605 B15R2.321 CN1C(CC(N)C1=O)c2c[n]ccc2 Amb25850762 [0,1,0,1,0,0|2,0,0]=4 3606 B15R2.321 CN1C(CC(O)C1=O)c2cccc[n]2 Amb25671953 [0,1,0,1,0,0|2,0,0]=4 3607 B15R2.321 CN1[C@@H](C[C@@H](Cl)C1=O)c2ccc[n]c2 Amb24519938 [0,1,0,1,0,0|2,0,0]=4 3608 B15R2.321 CN1[C@@H](C[C@H](Cl)C1=O)c2ccc[n]c2 Amb24519939 [0,1,0,1,0,0|2,0,0]=4 3609 B15R2.321 CN1[C@H](C[C@H](O)C1=O)c2c[n]ccc2 Amb24592528 [0,1,0,1,0,0|2,0,0]=4 3610 B15R2.321 O=C1[C@@H](O)C[C@H](N1C)c2cccnc2 Amb17615243 [0,1,0,1,0,0|2,0,0]=4 3611 B15R2.321 O=C1[C@H](O)C[C@H](N1C)c2cccnc2 Amb17615241 [0,1,0,1,0,0|2,0,0]=4 3612 B15R2.1601 C=CC(=O)C1Cc2ccccc2CC1 Amb25328340 [0,1,0,1,0,0|1,0,1]=4 3613 B15R2.1601 CCC(=O)C1Cc2ccccc2CC1 Amb24521747 [0,1,0,1,0,0|1,0,0]=3 3614 B15R2.1601 CCC(=O)C1Cc2ccccc2CN1 Amb25843088 [0,1,0,1,0,0|2,0,0]=4 3615 B15R2.1601 CCC(=O)C1Cc2ccccc2OC1 Amb25225446 [0,1,0,1,0,0|2,0,0]=4 3616 B15R2.1601 CNC(=O)C1CNc2ccccc2C1 Amb25818635 [0,1,0,1,0,0|2,0,0]=4 3617 B15R2.1601 CNC(=O)C1CNc2ccccc2N1 Amb25138680 [0,1,0,1,0,0|2,0,0]=4 3618 B15R2.1601 CNC(=O)C1COc2c(O1)cccc2 Amb1649043 [0,1,0,1,0,0|2,0,0]=4 3619 B15R2.1601 CNC(=O)C1Cc2ccccc2CO1 Amb22643159 [0,1,0,1,0,0|2,0,0]=4 3620 B15R2.1601 CNC(=O)C1Cc2ccccc2OC1 Amb25818664 [0,1,0,1,0,0|2,0,0]=4 3621 B15R2.1601 CNC(=O)N1CCc2c(C1)cccc2 Amb1952627 [0,1,0,1,0,0|2,0,0]=4 3622 B15R2.1601 COC(=N)C1COc2ccccc2C1 Amb24406290 [0,1,0,1,0,0|2,0,0]=4 3623 B15R2.1601 COC(=N)C1CSc2ccccc2O1 Amb25715591 [0,1,0,1,0,0|2,0,0]=4 3624 B15R2.1601 COC(=O)C1=Cc2c(OC1)cccc2 Amb2424227 [0,1,0,1,0,0|1,0,1]=4 3625 B15R2.1601 COC(=O)C1CCc2c(N1)cccc2 Amb2449505 [0,1,0,1,0,0|0,0,0]=2 3626 B15R2.1601 COC(=O)C1CCc2c[n]ccc2N1 Amb25124044 [0,1,0,1,0,0|1,0,0]=3 3627 B15R2.1601 COC(=O)C1CCc2ccccc2O1 Amb21961803 [0,1,0,1,0,0|0,0,0]=2 3628 B15R2.1601 COC(=O)C1CNc2[n]cccc2O1 Amb25065297 [0,1,0,1,0,0|2,0,0]=4 3629 B15R2.1601 COC(=O)C1CNc2c(O1)cccc2 Amb2511082 [0,1,0,1,0,0|1,0,0]=3 3630 B15R2.1601 COC(=O)C1COc2c(O1)cccc2 Amb2568269 [0,1,0,1,0,0|1,0,0]=3 3631 B15R2.1601 COC(=O)C1COc2ccccc2C1 Amb19245694 [0,1,0,1,0,0|1,0,0]=3 3632 B15R2.1601 COC(=O)C1COc2ccccc2N1 Amb24595009 [0,1,0,1,0,0|1,0,0]=3 3633 B15R2.1601 COC(=O)C1COc2ccccc2O1 Amb17659442 [0,1,0,1,0,0|1,0,0]=3 3634 B15R2.1601 COC(=O)C1Cc2c[n]c[n]c2CC1 Amb23453252 [0,1,0,1,0,0|2,0,0]=4 3635 B15R2.1601 COC(=O)C1Cc2ccc[n]c2CC1 Amb25777758 [0,1,0,1,0,0|1,0,0]=3 3636 B15R2.1601 COC(=O)C1NCc2c(C1)cccc2 Amb1934296 [0,1,0,1,0,0|1,0,0]=3 3637 B15R2.1601 COC(=O)C=1CNc2ccccc2C1 Amb24598200 [0,1,0,1,0,0|1,0,1]=4 3638 B15R2.1601 COC(=O)N1Cc2[n]cccc2CC1 Amb24096153 [0,1,0,1,0,0|2,0,0]=4 3639 B15R2.1601 COC(=O)[C@@H]1CCc2ccccc2N1 Amb23401514 [0,1,0,1,0,0|0,0,0]=2 3640 B15R2.1601 COC(=O)[C@@H]1CCc2ccccc2O1 Amb24182099 [0,1,0,1,0,0|0,0,0]=2 3641 B15R2.1601 COC(=O)[C@H]1Cc2ccccc2CC1 Amb25737089 [0,1,0,1,0,0|0,0,0]=2 3642 B15R2.1601 COC(=O)[C@H]1Cc2ccccc2CN1 Amb22225138 [0,1,0,1,0,0|1,0,0]=3 3643 B15R2.1601 NNC(=O)C1CCc2ccccc2N1 Amb24427673 [0,1,0,1,0,0|2,0,0]=4 3644 B15R2.1601 NNC(=O)C1Cc2ccccc2CC1 Amb25330918 [0,1,0,1,0,0|2,0,0]=4 3645 B15R2.1601 O=C(CBr)C1Cc2ccccc2CC1 Amb25226458 [0,1,0,1,0,0|2,0,0]=4 3646 B15R2.1611 COC(=O)C1(N)C=C1c2ccccc2 Amb25747625 [0,1,0,1,0,0|0,0,2]=4 3647 B15R2.1611 COC(=O)C1(N)CC1c2ccccc2 Amb24697540 [0,1,0,1,0,0|0,0,0]=2 3648 B15R2.1611 COC(=O)[C@@]1(N)C[C@@H]1c2ccccc2 Amb23453230 [0,1,0,1,0,0|0,0,0]=2 3649 B15R2.1611 COC(=O)[C@@]1(N)C[C@H]1c2ccccc2 Amb23453211 [0,1,0,1,0,0|0,0,0]=2 3650 B15R2.15770 CC1CNc2ccccc2N(C)C1=O Amb18863554 [0,1,0,1,0,0|2,0,0]=4 3651 B15R2.15770 CN1C(=O)C(N)CCc2ccccc12 Amb25070832 [0,1,0,1,0,0|1,0,0]=3 3652 B15R2.15770 CN1C(=O)[C@@H](N)CNc2ccccc12 Amb25689857 [0,1,0,1,0,0|2,0,0]=4 3653 B15R2.15770 O=C1C(C)COc2c(N1C)cccc2 Amb17570541 [0,1,0,1,0,0|2,0,0]=4 3654 B15R2.19402 COC(=O)C1(C)C=Cc2ccccc12 Amb17778896 [0,1,0,1,0,0|0,0,2]=4 3655 B15R2.19402 COC(=O)C1(N)CCc2ccccc12 Amb18949640 [0,1,0,1,0,0|0,0,0]=2 3656 B15R2.19402 COC(=O)C1(O)CCc2ccccc12 Amb19078825 [0,1,0,1,0,0|0,0,0]=2 3657 B15R2.19402 COC(=O)[C@@]1(N)CCc2ccccc12 Amb24564762 [0,1,0,1,0,0|0,0,0]=2 3658 B15R2.305 Cc1ccccc1CC2CC(=O)CC2 Amb25783494 [0,1,0,1,0,0|1,0,0]=3 3659 B15R2.305 Cc1ccccc1CC2CNC(=O)O2 Amb25035880 [0,1,0,1,0,0|2,0,0]=4 3660 B15R2.305 Cc1ccccc1CC2COC(N)=N2 Amb24402930 [0,1,0,1,0,0|2,0,0]=4 3661 B15R2.305 Cc1ccccc1CN2CCC(=O)C2 Amb19060551 [0,1,0,1,0,0|2,0,0]=4 3662 B15R2.305 Cc1ccccc1C[C@H]2COC(N)=N2 Amb25165985 [0,1,0,1,0,0|2,0,0]=4 3663 B15R2.305 Cc1ccccc1OC2CC(=O)CC2 Amb25121510 [0,1,0,1,0,0|2,0,0]=4 3664 B15R2.305 Cc1ccccc1SC2CC(=O)CC2 Amb24510808 [0,1,0,1,0,0|2,0,0]=4 3665 B15R2.305 NC1=N[C@@H](Cc2ccccc2F)CO1 Amb25165986 [0,1,0,1,0,0|2,0,0]=4 3666 B15R2.305 Nc1cc[n]cc1CC2CC(=O)CC2 Amb25354439 [0,1,0,1,0,0|2,0,0]=4 3667 B15R2.305 O=C1CC(CC1)Oc2ccccc2Cl Amb25664429 [0,1,0,1,0,0|2,0,0]=4 3668 B15R2.305 O=C1CC(CC1)Sc2ccccc2Cl Amb24751564 [0,1,0,1,0,0|2,0,0]=4 3669 B15R2.305 O=C1CC(CC1)Sc2ccccc2F Amb25358143 [0,1,0,1,0,0|2,0,0]=4 3670 B15R2.305 O=C1CC(Cc2ccccc2Cl)CN1 Amb24641482 [0,1,0,1,0,0|1,0,0]=3 3671 B15R2.305 O=C1CCC(Cc2ccccc2Cl)N1 Amb24412617 [0,1,0,1,0,0|2,0,0]=4 3672 B15R2.305 O=C1CCC(Cc2ccccc2F)N1 Amb24431534 [0,1,0,1,0,0|2,0,0]=4 3673 B15R2.305 O=C1NC(Cc2ccccc2Br)CO1 Amb25216305 [0,1,0,1,0,0|1,0,0]=3 3674 B15R2.305 O=C1NCC(Cc2ccccc2Br)O1 Amb25742899 [0,1,0,1,0,0|2,0,0]=4 3675 B15R2.305 Oc1ccccc1CC2CNC(=O)O2 Amb18651410 [0,1,0,1,0,0|2,0,0]=4 3676 B15R2.305 Oc1ccccc1CC2COC(=O)N2 Amb25270775 [0,1,0,1,0,0|1,0,0]=3 3677 B15R2.308 Cc1ccccc1C2CCC(=O)CC2 Amb18564515 [0,1,0,1,0,0|1,0,0]=3 3678 B15R2.308 Cc1ccccc1C2CNC(=O)CN2 Amb25028930 [0,1,0,1,0,0|2,0,0]=4 3679 B15R2.308 Nc1ccccc1C2CNC(=O)CC2 Amb24558734 [0,1,0,1,0,0|1,0,0]=3 3680 B15R2.308 Nc1ccccc1C2CNC(=O)CO2 Amb18863709 [0,1,0,1,0,0|2,0,0]=4 3681 B15R2.308 O=C1CCC(CC1)N2C=CC=CC2=O Amb25140985 [0,1,0,1,0,0|2,0,0]=4 3682 B15R2.308 O=C1CCC(CC1)c2ccc[n]c2F Amb24713537 [0,1,0,1,0,0|2,0,0]=4 3683 B15R2.308 O=C1CCC(CC1)c2ccccc2Br Amb18584295 [0,1,0,1,0,0|1,0,0]=3 3684 B15R2.308 O=C1CCC(CC1)c2ccccc2Cl Amb18568605 [0,1,0,1,0,0|1,0,0]=3 3685 B15R2.308 O=C1CCC(CC1)c2ccccc2F Amb18565088 [0,1,0,1,0,0|1,0,0]=3 3686 B15R2.308 O=C1CCC(CN1)c2ccccc2C Amb17401304 [0,1,0,1,0,0|1,0,0]=3 3687 B15R2.308 O=C1CCC(CN1)c2ccccc2Cl Amb17403923 [0,1,0,1,0,0|1,0,0]=3 3688 B15R2.308 O=C1CCC(CN1)c2ccccc2F Amb17401715 [0,1,0,1,0,0|1,0,0]=3 3689 B15R2.308 O=C1CCN(CC1)c2ccccc2N Amb17506932 [0,1,0,1,0,0|2,0,0]=4 3690 B15R2.308 O=C1COC(CN1)c2ccccc2Br Amb18878317 [0,1,0,1,0,0|2,0,0]=4 3691 B15R2.308 O=C1COC(CN1)c2ccccc2F Amb24444029 [0,1,0,1,0,0|2,0,0]=4 3692 B15R2.308 O=C1NCC(CN1)c2ccccc2Br Amb24439894 [0,1,0,1,0,0|2,0,0]=4 3693 B15R2.308 O=C1NCC(CN1)c2ccccc2F Amb25856369 [0,1,0,1,0,0|2,0,0]=4 3694 B15R2.308 O=C1NCC(CO1)c2ccccc2Br Amb24559544 [0,1,0,1,0,0|1,0,0]=3 3695 B15R2.308 O=C1NCC(CO1)c2ccccc2Cl Amb24536253 [0,1,0,1,0,0|1,0,0]=3 3696 B15R2.308 O=C1NCC(CO1)c2ccccc2F Amb25226758 [0,1,0,1,0,0|1,0,0]=3 3697 B15R2.308 Oc1cc[n]cc1C2CCC(=O)CC2 Amb24388535 [0,1,0,1,0,0|2,0,0]=4 3698 B15R2.308 Oc1ccccc1C2CNC(=O)OC2 Amb25238524 [0,1,0,1,0,0|1,0,0]=3 3699 B15R2.2170 CCC(=O)N1CCc2c(N)cccc12 Amb18669657 [0,1,0,1,0,0|2,0,0]=4 3700 B15R2.2170 COC(=O)C1NCc2c(Br)cccc21 Amb25732070 [0,1,0,1,0,0|1,0,0]=3 3701 B15R2.2170 COC(=O)N1CCc2c(N)cccc12 Amb18669655 [0,1,0,1,0,0|1,0,0]=3 3702 B15R2.2170 Cc1cccc2c1CCN2C(=O)OC Amb25064253 [0,1,0,1,0,0|1,0,0]=3 3703 B15R2.7473 CC1C(CCC1=O)c2ccccc2Cl Amb25167750 [0,1,0,1,0,0|1,0,0]=3 3704 B15R2.7473 CC1C(CCC1=O)c2ccccc2F Amb25037825 [0,1,0,1,0,0|1,0,0]=3 3705 B15R2.7473 CC1C(CNC1=O)c2ccccc2F Amb24630017 [0,1,0,1,0,0|2,0,0]=4 3706 B15R2.7473 CN1C(=O)CCN1c2ccccc2O Amb25208456 [0,1,0,1,0,0|2,0,0]=4 3707 B15R2.7473 CN1C(CCC1=O)C2=CC=CNC2=O Amb24599995 [0,1,0,1,0,0|2,0,0]=4 3708 B15R2.7473 CN1C(CCC1=O)c2c[n]ccc2N Amb18650871 [0,1,0,1,0,0|2,0,0]=4 3709 B15R2.7473 CN1C(CCC1=O)c2cccc[n+]2[O-] Amb25695347 [0,1,0,1,0,0|2,0,0]=4 3710 B15R2.7473 CN1C(CNC1=O)c2ccccc2Br Amb25282910 [0,1,0,1,0,0|2,0,0]=4 3711 B15R2.7473 CN1C(CNC1=O)c2ccccc2F Amb24359132 [0,1,0,1,0,0|2,0,0]=4 3712 B15R2.7473 CN1C(COC1=O)c2ccccc2N Amb25234198 [0,1,0,1,0,0|2,0,0]=4 3713 B15R2.7473 CN1C(NCC1=O)c2ccccc2Br Amb25283913 [0,1,0,1,0,0|2,0,0]=4 3714 B15R2.7473 CN1C(NCC1=O)c2ccccc2Cl Amb25056640 [0,1,0,1,0,0|2,0,0]=4 3715 B15R2.7473 CN1C(NCC1=O)c2ccccc2I Amb25740153 [0,1,0,1,0,0|2,0,0]=4 3716 B15R2.7473 CN1C(NCC1=O)c2ccccc2O Amb24349983 [0,1,0,1,0,0|2,0,0]=4 3717 B15R2.7473 CN1[C@@H](CCC1=O)C2=CC=CNC2=O Amb25113999 [0,1,0,1,0,0|2,0,0]=4 3718 B15R2.7473 CN1[C@@H](CCC1=O)c2c[n]ccc2N Amb25818531 [0,1,0,1,0,0|2,0,0]=4 3719 B15R2.7473 Cc1ccccc1C2CNC(=O)C2C Amb25690828 [0,1,0,1,0,0|2,0,0]=4 3720 B15R2.7473 Cc1ccccc1C2CNC(=O)N2C Amb24385318 [0,1,0,1,0,0|2,0,0]=4 3721 B15R2.19074 CCC(=O)C1CC1c2ccccc2O Amb24646439 [0,1,0,1,0,0|1,0,0]=3 3722 B15R2.19074 CCC(=O)[C@H]1C[C@@H]1c2ccccc2O Amb24583612 [0,1,0,1,0,0|1,0,0]=3 3723 B15R2.19074 CNC(=O)C1CC1c2ccccc2Cl Amb16096376 [0,1,0,1,0,0|1,0,0]=3 3724 B15R2.19074 COC(=O)C1CC1c2ccccc2O Amb24380864 [0,1,0,1,0,0|0,0,0]=2 3725 B15R2.19074 COC(=O)C1OC1c2ccccc2Br Amb19930048 [0,1,0,1,0,0|1,0,0]=3 3726 B15R2.19074 COC(=O)C1OC1c2ccccc2Cl Amb19930050 [0,1,0,1,0,0|1,0,0]=3 3727 B15R2.19074 COC(=O)C1OC1c2ccccc2F Amb19930053 [0,1,0,1,0,0|1,0,0]=3 3728 B15R2.19074 Cc1ccccc1C2OC2C(=O)OC Amb19930058 [0,1,0,1,0,0|1,0,0]=3 3729 B15R2.42442 Cc1cccc2c1NCCC(=O)N2C Amb24521752 [0,1,0,1,0,0|2,0,0]=4 3730 B15R2.42442 O=C1CCOc2c(N1C)cccc2Br Amb17573811 [0,1,0,1,0,0|2,0,0]=4 3731 B15R2.42442 O=C1CCOc2c(N1C)cccc2C Amb17570551 [0,1,0,1,0,0|2,0,0]=4 3732 B15R2.42442 O=C1CCOc2c(N1C)cccc2Cl Amb17571355 [0,1,0,1,0,0|2,0,0]=4 3733 B15R2.42442 O=C1CCOc2c(N1C)cccc2F Amb17570728 [0,1,0,1,0,0|2,0,0]=4 3734 B15R2.42442 O=C1CCOc2c(N1C)cccc2N Amb17570657 [0,1,0,1,0,0|2,0,0]=4 3735 B15R2.28 Cc1cc(c[n]c1)C2CCC(=O)CC2 Amb25665587 [0,1,0,1,0,0|2,0,0]=4 3736 B15R2.28 Cc1cc(ccc1)C2CCC(=O)CC2 Amb18066220 [0,1,0,1,0,0|1,0,0]=3 3737 B15R2.28 Nc1cc(ccc1)C2CNC(=O)CO2 Amb18863708 [0,1,0,1,0,0|2,0,0]=4 3738 B15R2.28 Nc1cc(ccc1)C2CNC(=O)OC2 Amb18863711 [0,1,0,1,0,0|1,0,0]=3 3739 B15R2.28 Nc1cc(ccc1)N2CCC(=O)CC2 Amb25801104 [0,1,0,1,0,0|2,0,0]=4 3740 B15R2.28 Nc1cccc([n]1)C2CCC(=O)CC2 Amb25095342 [0,1,0,1,0,0|2,0,0]=4 3741 B15R2.28 O=C1CCC(CC1)c2cccc(Br)c2 Amb18584293 [0,1,0,1,0,0|1,0,0]=3 3742 B15R2.28 O=C1CCC(CC1)c2cccc(Cl)c2 Amb18568606 [0,1,0,1,0,0|1,0,0]=3 3743 B15R2.28 O=C1CCC(CC1)c2cccc(F)c2 Amb18565090 [0,1,0,1,0,0|1,0,0]=3 3744 B15R2.28 O=C1CCC(CN1)c2cccc(c2)Br Amb17414213 [0,1,0,1,0,0|1,0,0]=3 3745 B15R2.28 O=C1CCC(CN1)c2cccc(c2)C Amb17401307 [0,1,0,1,0,0|1,0,0]=3 3746 B15R2.28 O=C1CCC(CN1)c2cccc(c2)Cl Amb17403926 [0,1,0,1,0,0|1,0,0]=3 3747 B15R2.28 O=C1CNC(CN1)c2cccc(Br)c2 Amb24685332 [0,1,0,1,0,0|2,0,0]=4 3748 B15R2.28 O=C1COC(CN1)c2cccc(Br)c2 Amb18229978 [0,1,0,1,0,0|2,0,0]=4 3749 B15R2.28 O=C1COC(CN1)c2cccc(Cl)c2 Amb25145017 [0,1,0,1,0,0|2,0,0]=4 3750 B15R2.28 O=C1COC(CN1)c2cccc(I)c2 Amb25231671 [0,1,0,1,0,0|2,0,0]=4 3751 B15R2.28 O=C1CO[C@H](CN1)c2cccc(F)c2 Amb25699270 [0,1,0,1,0,0|2,0,0]=4 3752 B15R2.28 O=C1NCC(CN1)c2cccc(F)c2 Amb24733528 [0,1,0,1,0,0|2,0,0]=4 3753 B15R2.1115 Cc1cc(CC2CNC(=O)C2)ccc1 Amb24467675 [0,1,0,1,0,0|1,0,0]=3 3754 B15R2.1115 Cc1cc(CC2COC(N)=N2)ccc1 Amb24342877 [0,1,0,1,0,0|2,0,0]=4 3755 B15R2.1115 Cc1cc(CN2CCC(=O)C2)ccc1 Amb19060552 [0,1,0,1,0,0|2,0,0]=4 3756 B15R2.1115 Cc1cc(C[C@H]2COC(N)=N2)ccc1 Amb25077288 [0,1,0,1,0,0|2,0,0]=4 3757 B15R2.1115 Cc1cc(ccc1)SC2CC(=O)CC2 Amb25115278 [0,1,0,1,0,0|2,0,0]=4 3758 B15R2.1115 NC1=N[C@@H](Cc2cccc(Cl)c2)CO1 Amb24547023 [0,1,0,1,0,0|2,0,0]=4 3759 B15R2.1115 NC1=N[C@@H](Cc2cccc(F)c2)CO1 Amb25250688 [0,1,0,1,0,0|2,0,0]=4 3760 B15R2.1115 Nc1cc(CC2CCC(=O)N2)ccc1 Amb18819187 [0,1,0,1,0,0|2,0,0]=4 3761 B15R2.1115 O=C1CC(CC1)Oc2cccc(Cl)c2 Amb24455234 [0,1,0,1,0,0|2,0,0]=4 3762 B15R2.1115 O=C1CC(CC1)Sc2cccc(Br)c2 Amb24521190 [0,1,0,1,0,0|2,0,0]=4 3763 B15R2.1115 O=C1CC(CC1)Sc2cccc(Cl)c2 Amb24510809 [0,1,0,1,0,0|2,0,0]=4 3764 B15R2.1115 O=C1CC(Cc2cccc(F)c2)CC1 Amb25710201 [0,1,0,1,0,0|1,0,0]=3 3765 B15R2.1115 O=C1CC(Cc2cccc(F)c2)CO1 Amb24450058 [0,1,0,1,0,0|0,0,0]=2 3766 B15R2.1115 O=C1CCC(Cc2cccc(F)c2)N1 Amb25058334 [0,1,0,1,0,0|2,0,0]=4 3767 B15R2.1115 O=C1NCC(Cc2cccc(Cl)c2)O1 Amb25103692 [0,1,0,1,0,0|2,0,0]=4 3768 B15R2.1115 O=C1NCC(Cc2cccc(F)c2)O1 Amb24506386 [0,1,0,1,0,0|2,0,0]=4 3769 B15R2.1115 Oc1cc(CC2CCC(=O)O2)ccc1 Amb20668453 [0,1,0,1,0,0|2,0,0]=4 3770 B15R2.1115 Oc1cc(CC2CNC(=O)C2)ccc1 Amb25843139 [0,1,0,1,0,0|1,0,0]=3 3771 B15R2.1115 Oc1cc(C[C@@H]2CCC(=O)O2)ccc1 Amb24506328 [0,1,0,1,0,0|2,0,0]=4 3772 B15R2.1115 Oc1cc(C[C@H]2CCC(=O)O2)ccc1 Amb25073401 [0,1,0,1,0,0|2,0,0]=4 3773 B15R2.3809 CNC(=O)C1CC1c2cccc(c2)Br Amb13324012 [0,1,0,1,0,0|1,0,0]=3 3774 B15R2.3809 CNC(=O)C1CC1c2cccc(c2)Cl Amb13324011 [0,1,0,1,0,0|1,0,0]=3 3775 B15R2.3809 COC(=O)C1OC1c2cc(Br)ccc2 Amb19930049 [0,1,0,1,0,0|1,0,0]=3 3776 B15R2.3809 COC(=O)C1OC1c2cc(Cl)ccc2 Amb19930051 [0,1,0,1,0,0|1,0,0]=3 3777 B15R2.3809 COC(=O)C1OC1c2cc(F)ccc2 Amb19930054 [0,1,0,1,0,0|1,0,0]=3 3778 B15R2.3809 Cc1cc(ccc1)C2OC2C(=O)OC Amb19930059 [0,1,0,1,0,0|1,0,0]=3 3779 B15R2.7137 CC1C(CCC1=O)c2cc(F)c[n]c2 Amb25167799 [0,1,0,1,0,0|2,0,0]=4 3780 B15R2.7137 CN1C(CCC1=O)c2c[n+]([O-])ccc2 Amb24355974 [0,1,0,1,0,0|2,0,0]=4 3781 B15R2.7137 CN1C(NCC1=O)c2cccc(Br)c2 Amb24337720 [0,1,0,1,0,0|2,0,0]=4 3782 B15R2.7137 CN1C(SCC1=O)c2cccc(O)c2 Amb24570414 [0,1,0,1,0,0|2,0,0]=4 3783 B15R2.7137 CN1[C@@H](CCC1=O)c2ccc[n+]([O-])c2 Amb17671977 [0,1,0,1,0,0|2,0,0]=4 3784 B15R2.7137 CN1[C@@H](COC1=O)c2cccc(N)c2 Amb24470834 [0,1,0,1,0,0|2,0,0]=4 3785 B15R2.7137 Cc1cc(ccc1)C2CCC(=O)C2C Amb24691141 [0,1,0,1,0,0|1,0,0]=3 3786 B15R2.7137 Cc1cncc(c1)C2CCC(=O)N2C Amb17617285 [0,1,0,1,0,0|2,0,0]=4 3787 B15R2.8656 CC1C(=O)NCCc2cccc(Cl)c21 Amb24453842 [0,1,0,1,0,0|2,0,0]=4 3788 B15R2.19094 CCC(=O)C1CCc2cc(F)ccc21 Amb25761406 [0,1,0,1,0,0|1,0,0]=3 3789 B15R2.19094 CCC(=O)N1CCc2c1ccc(c2)Br Amb10074096 [0,1,0,1,0,0|2,0,0]=4 3790 B15R2.19094 CCC(=O)N1CCc2cc(Cl)ccc12 Amb18866070 [0,1,0,1,0,0|2,0,0]=4 3791 B15R2.19094 CCC(=O)N1CCc2cc(F)ccc12 Amb25278877 [0,1,0,1,0,0|2,0,0]=4 3792 B15R2.19094 CNC(=O)N1CCc2cc(Cl)ccc12 Amb25222558 [0,1,0,1,0,0|2,0,0]=4 3793 B15R2.19094 CNC(=O)N1CCc2cc(O)ccc12 Amb24401605 [0,1,0,1,0,0|2,0,0]=4 3794 B15R2.19094 COC(=O)C1CCc2[n]c(Br)ccc21 Amb24623501 [0,1,0,1,0,0|1,0,0]=3 3795 B15R2.19094 COC(=O)C1CCc2[n]c(Cl)ccc21 Amb24704418 [0,1,0,1,0,0|1,0,0]=3 3796 B15R2.19094 COC(=O)C1CCc2[n]c(N)[n]cc21 Amb23596894 [0,1,0,1,0,0|2,0,0]=4 3797 B15R2.19094 COC(=O)C1CCc2[n]c(S)[n]cc21 Amb23596898 [0,1,0,1,0,0|2,0,0]=4 3798 B15R2.19094 COC(=O)C1CCc2cc(Br)ccc21 Amb25819071 [0,1,0,1,0,0|0,0,0]=2 3799 B15R2.19094 COC(=O)C1CCc2cc(Cl)ccc21 Amb24506947 [0,1,0,1,0,0|0,0,0]=2 3800 B15R2.19094 COC(=O)C1CCc2cc(N)ccc21 Amb22002308 [0,1,0,1,0,0|0,0,0]=2 3801 B15R2.19094 COC(=O)C1CCc2cc(N)ccc21 Amb22234408 [0,1,0,1,0,0|0,0,0]=2 3802 B15R2.19094 COC(=O)C1CCc2cc(O)ccc21 Amb25373188 [0,1,0,1,0,0|0,0,0]=2 3803 B15R2.19094 COC(=O)C1N=Nc2cc(N)ccc21 Amb25301332 [0,1,0,1,0,0|2,0,0]=4 3804 B15R2.19094 COC(=O)C1NCc2cc(Br)ccc21 Amb25168004 [0,1,0,1,0,0|1,0,0]=3 3805 B15R2.19094 COC(=O)N1CCc2cc(Br)ccc12 Amb18229904 [0,1,0,1,0,0|1,0,0]=3 3806 B15R2.19094 COC(=O)N1CCc2cc(Cl)ccc12 Amb18866288 [0,1,0,1,0,0|1,0,0]=3 3807 B15R2.19094 COC(=O)N1CCc2cc(O)ccc12 Amb25724428 [0,1,0,1,0,0|1,0,0]=3 3808 B15R2.19094 CON(C)C1CCc2cc(N)ccc21 Amb24636557 [0,1,0,1,0,0|2,0,0]=4 3809 B15R2.19094 Cc1[n]c2CCC(C(=O)OC)c2c[n]1 Amb23596895 [0,1,0,1,0,0|2,0,0]=4 3810 B15R2.19491 COC(=O)C[C@H]1Cc2cc(O)ccc21 Amb25092939 [0,1,0,1,0,0|0,0,0]=2 3811 B15R2.63978 Brc1ccc2c(c1)OCCC(=O)N2C Amb17573807 [0,1,0,1,0,0|2,0,0]=4 3812 B15R2.63978 CN1C(=O)CCCc2cc(Br)ccc12 Amb25360274 [0,1,0,1,0,0|1,0,0]=3 3813 B15R2.63978 CN1C(=O)CCCc2cc(Cl)ccc12 Amb24429973 [0,1,0,1,0,0|1,0,0]=3 3814 B15R2.63978 CN1C(=O)CCCc2cc(I)ccc12 Amb24521980 [0,1,0,1,0,0|1,0,0]=3 3815 B15R2.63978 CN1C(=O)CNCc2cc(Br)ccc12 Amb24518792 [0,1,0,1,0,0|2,0,0]=4 3816 B15R2.63978 CN1C(=O)CNCc2cc(Cl)ccc12 Amb25208508 [0,1,0,1,0,0|2,0,0]=4 3817 B15R2.63978 CN1C(=O)OCCc2cc(N)ccc12 Amb25764535 [0,1,0,1,0,0|2,0,0]=4 3818 B15R2.63978 Nc1ccc2c(c1)OCCC(=O)N2C Amb17570654 [0,1,0,1,0,0|2,0,0]=4 3819 B15R2.79451 CNC(=O)N1CCc2cccc(N)c12 Amb25064881 [0,1,0,1,0,0|2,0,0]=4 3820 B15R2.79451 COC(=O)C1CCC2=NC=CC(=O)N21 Amb25752864 [0,1,0,1,0,0|2,0,0]=4 3821 B15R2.79451 COC(=O)N1CCc2cccc(N)c12 Amb24465321 [0,1,0,1,0,0|1,0,0]=3 3822 B15R2.616 CC1(C)C(CC1=O)Oc2ccccc2 Amb25708803 [0,1,0,1,0,0|2,0,0]=4 3823 B15R2.616 CC1(C)C(Cc2ccccc2)OC1=O Amb24701181 [0,1,0,1,0,0|2,0,0]=4 3824 B15R2.616 O=C1CC(Cc2ccccc2)C1(Cl)Cl Amb25848618 [0,1,0,1,0,0|2,0,0]=4 3825 B15R2.1255 CC(=C)C(=O)C1CCc2ccccc21 Amb24621377 [0,1,0,1,0,0|1,0,0]=3 3826 B15R2.1255 CC(=C)C(=O)C1CNc2ccccc21 Amb24460380 [0,1,0,1,0,0|2,0,0]=4 3827 B15R2.1255 CC(=C)C(=O)C1COc2ccccc21 Amb24731715 [0,1,0,1,0,0|2,0,0]=4 3828 B15R2.1255 CC(=O)C(=O)N1CCc2c1cccc2 Amb17401264 [0,1,0,1,0,0|2,0,0]=4 3829 B15R2.1255 CC(C)C(=O)C1COc2ccccc21 Amb25709294 [0,1,0,1,0,0|2,0,0]=4 3830 B15R2.1255 CC(N)C(=O)C1CCc2ccc[n]c21 Amb25104634 [0,1,0,1,0,0|2,0,0]=4 3831 B15R2.1255 CN(C)C(=N)C1CCc2ccccc21 Amb24381297 [0,1,0,1,0,0|2,0,0]=4 3832 B15R2.1255 CN(C)C(=O)C1COc2ccccc21 Amb25296809 [0,1,0,1,0,0|2,0,0]=4 3833 B15R2.1255 CN(C)C(=O)C1CSc2ccccc21 Amb24271509 [0,1,0,1,0,0|2,0,0]=4 3834 B15R2.1255 C[C@@H](N)C(=O)N1CCc2ccccc12 Amb18014672 [0,1,0,1,0,0|2,0,0]=4 3835 B15R2.1255 O=C(N1CCc2c1cccc2)C(Br)C Amb10767357 [0,1,0,1,0,0|2,0,0]=4 3836 B15R2.1255 O=C(N1CCc2c1cccc2)C(Cl)C Amb2279133 [0,1,0,1,0,0|2,0,0]=4 3837 B15R2.1255 O=C(N1CCc2c1cccc2)C(N)C Amb13952625 [0,1,0,1,0,0|2,0,0]=4 3838 B15R2.1255 O=C(N1CCc2c1cccc2)C(O)C Amb17401511 [0,1,0,1,0,0|2,0,0]=4 3839 B15R2.4092 CC1(O)C(CNC1=O)c2ccccc2 Amb25698421 [0,1,0,1,0,0|2,0,0]=4 3840 B15R2.4092 O=C1CCC(C1(Cl)Cl)c2ccccc2 Amb17596284 [0,1,0,1,0,0|2,0,0]=4 3841 B15R2.4232 CC(C)C(=O)C1CC1c2ccccc2 Amb24401992 [0,1,0,1,0,0|1,0,0]=3 3842 B15R2.4232 CC(O)C(=O)C1CC1c2ccccc2 Amb25775661 [0,1,0,1,0,0|1,0,0]=3 3843 B15R2.4232 CN(C)C(=O)C1CC1c2ccccc2 Amb24499250 [0,1,0,1,0,0|1,0,0]=3 3844 B15R2.107888 CC(=C)C(=O)CC1Cc2ccccc21 Amb25360314 [0,1,0,1,0,0|1,0,0]=3 3845 B15R2.107888 CC(N)C(=O)CC1Cc2ccccc21 Amb25196593 [0,1,0,1,0,0|1,0,0]=3 3846 B15R2.107888 OC(=O)C(=O)CC1Cc2ccccc21 Amb25267018 [0,1,0,1,0,0|2,0,0]=4 3847 B15R3.514 O=C1CC2C(C2C1)c3ccccc3 Amb25767871 [0,0,0,2,0,0|1,0,0]=3 3848 B15R3.514 O=C1C[C@@H]2[C@H]([C@@H]2C1)c3ccccc3 Amb24633553 [0,0,0,2,0,0|1,0,0]=3 3849 B15R3.2007 O=C1CC2Cc3ccccc3C1C2 Amb25044276 [0,0,0,2,0,0|1,0,0]=3 3850 B15R3.2009 O=C1C[C@H]2Cc3ccccc3[C@H]2O1 Amb24087833 [0,0,0,2,0,0|0,0,0]=2 3851 B15R3.2009 O=C1NC2C(Cc3ccccc32)S1 Amb24409700 [0,0,0,2,0,0|2,0,0]=4 3852 B15R3.2009 O=C1NC2Cc3ccccc3C2O1 Amb24343848 [0,0,0,2,0,0|1,0,0]=3 3853 B15R3.2009 O=C1N[C@@H]2Cc3ccccc3[C@@H]2O1 Amb24600055 [0,0,0,2,0,0|1,0,0]=3 3854 B15R3.2009 O=C1N[C@@H]2[C@@H](Cc3ccccc32)O1 Amb22336679 [0,0,0,2,0,0|2,0,0]=4 3855 B15R3.2009 O=C1O[C@@H]2[C@H](N1)c3c(C2)cccc3 Amb16227034 [0,0,0,2,0,0|2,0,0]=4 3856 B15R3.2254 O=C1CC[C@@H]2[C@@H]([C@H]12)c3ccccc3 Amb24602972 [0,0,0,2,0,0|1,0,0]=3 3857 B15R3.2254 O=C1CC[C@@H]2[C@H]([C@H]12)c3ccccc3 Amb24600981 [0,0,0,2,0,0|1,0,0]=3 3858 B15R3.2254 O=C1CC[C@H]2[C@@H]([C@@H]12)c3ccccc3 Amb24588953 [0,0,0,2,0,0|1,0,0]=3 3859 B15R3.10083 O=C1CCC2Cc3ccccc3C12 Amb24492693 [0,0,0,2,0,0|1,0,0]=3 3860 B15R3.10083 O=C1CCC2Cc3ccccc3N12 Amb25705294 [0,0,0,2,0,0|2,0,0]=4 3861 B15R3.10083 O=C1OC[C@@H]2Cc3ccccc3N12 Amb25710714 [0,0,0,2,0,0|1,0,0]=3 3862 B15R3.485 O=C1C[C@@H]2[C@H]1CCc3ccccc32 Amb24629252 [0,0,0,2,0,0|1,0,0]=3 3863 B15R3.485 O=C1N[C@@H]2[C@H]1CCc3c2cccc3 Amb1994019 [0,0,0,2,0,0|1,0,0]=3 3864 B15R3.485 O=C1N[C@H]2[C@@H]1CCc3c2cccc3 Amb1994021 [0,0,0,2,0,0|1,0,0]=3 3865 B15R3.73 O=C1CC2C(CC1)c3ccccc32 Amb24416747 [0,0,0,2,0,0|1,0,0]=3 3866 B15R3.76 O=C1C=CC2CC1c3ccccc32 Amb25318872 [0,0,0,2,0,0|1,0,1]=4 3867 B15R3.76 O=C1C=C[C@@H]2C[C@H]1c3ccccc32 Amb25334969 [0,0,0,2,0,0|1,0,1]=4 3868 B15R3.76 O=C1NCC2CC1c3ccccc23 Amb10603362 [0,0,0,2,0,0|1,0,0]=3 3869 B15R3.76 O=C1NC[C@H]2C[C@@H]1c3ccccc32 Amb24602880 [0,0,0,2,0,0|1,0,0]=3 3870 B15R3.704 O=C1CCC2(CC21)c3ccccc3 Amb25833606 [0,0,0,2,0,0|1,0,0]=3 3871 B15R3.9094 C[C@@H]1[C@H]2C[C@@H](C1=O)c3ccccc32 Amb25358821 [0,0,0,2,0,0|1,0,0]=3 3872 B15R3.9094 O=C1C2CC(c3ccccc32)C1=O Amb24492697 [0,0,0,2,0,0|2,0,0]=4 3873 B15R3.2044 CC12C(Cc3ccccc13)CC2=O Amb24534701 [0,0,0,2,0,0|1,0,0]=3 3874 B15R3.2249 O=C1CCC2C1Cc3ccccc32 Amb24662390 [0,0,0,2,0,0|1,0,0]=3 3875 B15R3.2249 O=C1CCC=2c3ccccc3CC21 Amb24492404 [0,0,0,2,0,0|1,0,1]=4 3876 B15R3.2249 O=C1NCC2C1Cc3ccccc32 Amb24548907 [0,0,0,2,0,0|2,0,0]=4 3877 B15R3.15145 O=C1CC2Cc3ccccc3CC12 Amb25298480 [0,0,0,2,0,0|1,0,0]=3 3878 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [1,0,0,0,1,0|2,0,0]=4 3879 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,0,0,0,1,0|2,0,0]=4 3880 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,1,0|2,0,0]=4 3881 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,1,0|2,0,0]=4 3882 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,0,0,0,1,0|2,0,0]=4 3883 B11R1.91 CC(=O)CCN1CC=CC=C1 Amb24676819 [1,0,0,0,1,0|1,0,1]=4 3884 B11R1.91 CC(=O)CCc1[n]ccc[n]1 Amb24726140 [1,0,0,0,1,0|2,0,0]=4 3885 B11R1.91 CC(=O)CCc1c[n]cc[n]1 Amb25307907 [1,0,0,0,1,0|2,0,0]=4 3886 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,1,0|1,0,0]=3 3887 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,1,0|1,0,0]=3 3888 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,1,0|1,0,0]=3 3889 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,1,0|1,0,0]=3 3890 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [1,0,0,0,1,0|2,0,0]=4 3891 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,1,0|1,0,0]=3 3892 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [1,0,0,0,1,0|2,0,0]=4 3893 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [1,0,0,0,1,0|2,0,0]=4 3894 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [1,0,0,0,1,0|2,0,0]=4 3895 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [1,0,0,0,1,0|2,0,0]=4 3896 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,0,0,0,1,0|0,0,2]=4 3897 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,1,0|0,0,2]=4 3898 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,0,0,0,1,0|1,0,1]=4 3899 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,1,0|2,0,0]=4 3900 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,1,0|1,1,0]=4 3901 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,0,0,0,1,0|1,1,0]=4 3902 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [1,0,0,0,1,0|2,0,0]=4 3903 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,0,0,0,1,0|2,0,0]=4 3904 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,1,0|0,0,2]=4 3905 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,1,0|0,0,2]=4 3906 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [1,0,0,0,1,0|1,1,0]=4 3907 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,1,0|2,0,0]=4 3908 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,1,0|2,0,0]=4 3909 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,1,0|2,0,0]=4 3910 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,1,0|1,1,0]=4 3911 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [1,0,0,0,1,0|2,0,0]=4 3912 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [1,0,0,0,1,0|2,0,0]=4 3913 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [1,0,0,0,1,0|0,1,0]=3 3914 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [1,0,0,0,1,0|2,0,0]=4 3915 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [1,0,0,0,1,0|1,0,1]=4 3916 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [1,0,0,0,1,0|2,0,0]=4 3917 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [1,0,0,0,1,0|2,0,0]=4 3918 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [1,0,0,0,1,0|2,0,0]=4 3919 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,0,0,0,1,0|0,0,0]=2 3920 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [1,0,0,0,1,0|1,0,0]=3 3921 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [1,0,0,0,1,0|1,0,0]=3 3922 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [1,0,0,0,1,0|1,0,0]=3 3923 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [1,0,0,0,1,0|2,0,0]=4 3924 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [1,0,0,0,1,0|2,0,0]=4 3925 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [1,0,0,0,1,0|2,0,0]=4 3926 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [1,0,0,0,1,0|2,0,0]=4 3927 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [1,0,0,0,1,0|2,0,0]=4 3928 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [1,0,0,0,1,0|2,0,0]=4 3929 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [1,0,0,0,1,0|2,0,0]=4 3930 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [1,0,0,0,1,0|2,0,0]=4 3931 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [1,0,0,0,1,0|1,0,0]=3 3932 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [1,0,0,0,1,0|1,0,0]=3 3933 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [1,0,0,0,1,0|1,0,0]=3 3934 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [1,0,0,0,1,0|2,0,0]=4 3935 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [1,0,0,0,1,0|2,0,0]=4 3936 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [1,0,0,0,1,0|1,0,0]=3 3937 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [1,0,0,0,1,0|2,0,0]=4 3938 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [1,0,0,0,1,0|1,0,0]=3 3939 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,0,0,0,1,0|0,0,0]=2 3940 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [1,0,0,0,1,0|0,0,2]=4 3941 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [1,0,0,0,1,0|1,0,1]=4 3942 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [1,0,0,0,1,0|0,0,2]=4 3943 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [1,0,0,0,1,0|2,0,0]=4 3944 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [1,0,0,0,1,0|2,0,0]=4 3945 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,0,0,0,1,0|0,0,0]=2 3946 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [1,0,0,0,1,0|0,2,0]=4 3947 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [1,0,0,0,1,0|0,0,1]=3 3948 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [1,0,0,0,1,0|1,0,1]=4 3949 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [1,0,0,0,1,0|1,0,1]=4 3950 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [1,0,0,0,1,0|1,0,1]=4 3951 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [1,0,0,0,1,0|1,0,1]=4 3952 B11R1.172 CC(=O)CCCc1c[n]c[s]1 Amb25379875 [1,0,0,0,1,0|2,0,0]=4 3953 B11R1.172 CC(=O)CCCc1ccco1 Amb17232099 [1,0,0,0,1,0|1,0,0]=3 3954 B11R1.172 CC(=O)CCCc1cccs1 Amb17232678 [1,0,0,0,1,0|1,0,0]=3 3955 B11R1.172 CC(=O)COCc1ccc[s]1 Amb18185636 [1,0,0,0,1,0|2,0,0]=4 3956 B11R1.172 CC(=O)COCc1ccco1 Amb18182896 [1,0,0,0,1,0|2,0,0]=4 3957 B11R1.172 CC(=O)NCCc1ccoc1 Amb22643451 [1,0,0,0,1,0|2,0,0]=4 3958 B11R1.172 CC(=O)NCCc1cscc1 Amb13821361 [1,0,0,0,1,0|2,0,0]=4 3959 B11R1.172 CC(=O)NCCn1cccc1 Amb2409180 [1,0,0,0,1,0|2,0,0]=4 3960 B11R1.172 CC(=O)OCC[n]1cccc1 Amb25383043 [1,0,0,0,1,0|2,0,0]=4 3961 B11R1.172 CC(=O)OCCc1cc[s]c1 Amb24756180 [1,0,0,0,1,0|2,0,0]=4 3962 B11R1.172 CC(=O)OCCc1ccc[s]1 Amb24756179 [1,0,0,0,1,0|2,0,0]=4 3963 B11R1.172 NC(=O)CCCn1cccc1 Amb13865744 [1,0,0,0,1,0|2,0,0]=4 3964 B11R1.172 OC(=O)CCCc1[nH]cc[n]1 Amb18200818 [1,0,0,0,1,0|2,0,0]=4 3965 B11R1.172 OC(=O)CCCc1[n]cc[s]1 Amb18198612 [1,0,0,0,1,0|2,0,0]=4 3966 B11R1.172 OC(=O)CCCc1[n]cco1 Amb18559420 [1,0,0,0,1,0|2,0,0]=4 3967 B11R1.172 OC(=O)CCCc1c[nH]nc1 Amb10607364 [1,0,0,0,1,0|2,0,0]=4 3968 B11R1.172 OC(=O)CCCc1c[n]c[nH]1 Amb18200801 [1,0,0,0,1,0|2,0,0]=4 3969 B11R1.172 OC(=O)CCCc1c[n]c[s]1 Amb18198607 [1,0,0,0,1,0|2,0,0]=4 3970 B11R1.172 OC(=O)CCCc1c[n]co1 Amb18200538 [1,0,0,0,1,0|2,0,0]=4 3971 B11R1.172 OC(=O)CCCc1c[n]oc1 Amb25382179 [1,0,0,0,1,0|2,0,0]=4 3972 B11R1.172 OC(=O)CCCc1c[s]c[n]1 Amb18062607 [1,0,0,0,1,0|2,0,0]=4 3973 B11R1.172 OC(=O)CCCc1cc[nH][n]1 Amb18200791 [1,0,0,0,1,0|2,0,0]=4 3974 B11R1.172 OC(=O)CCCc1cc[nH]c1 Amb18065398 [1,0,0,0,1,0|1,0,0]=3 3975 B11R1.172 OC(=O)CCCc1cc[n]o1 Amb18200545 [1,0,0,0,1,0|2,0,0]=4 3976 B11R1.172 OC(=O)CCCc1cc[s][n]1 Amb18198614 [1,0,0,0,1,0|2,0,0]=4 3977 B11R1.172 OC(=O)CCCc1cc[s]c1 Amb22000608 [1,0,0,0,1,0|1,0,0]=3 3978 B11R1.172 OC(=O)CCCc1ccco1 Amb18125675 [1,0,0,0,1,0|1,0,0]=3 3979 B11R1.172 OC(=O)CCCc1cccs1 Amb1152340 [1,0,0,0,1,0|1,0,0]=3 3980 B11R1.172 OC(=O)CCCc1cco[n]1 Amb24062140 [1,0,0,0,1,0|2,0,0]=4 3981 B11R1.172 OC(=O)CCCc1ccoc1 Amb25385034 [1,0,0,0,1,0|1,0,0]=3 3982 B11R1.172 OC(=O)CCCc1coc[n]1 Amb18200521 [1,0,0,0,1,0|2,0,0]=4 3983 B11R1.172 OC(=O)CCCn1cccc1 Amb1130872 [1,0,0,0,1,0|1,0,0]=3 3984 B11R1.172 OC(=O)CCCn1cncc1 Amb13949166 [1,0,0,0,1,0|2,0,0]=4 3985 B11R1.172 OC(=O)CCN[n]1cccc1 Amb25379965 [1,0,0,0,1,0|2,0,0]=4 3986 B11R1.172 OC(=O)CNCc1cc[nH]c1 Amb18243535 [1,0,0,0,1,0|2,0,0]=4 3987 B11R1.172 OC(=O)CNCc1ccc[nH]1 Amb18308340 [1,0,0,0,1,0|2,0,0]=4 3988 B11R1.172 OC(=O)COCc1ccc[s]1 Amb19015456 [1,0,0,0,1,0|2,0,0]=4 3989 B11R1.172 OC(=O)CSCc1ccoc1 Amb18647634 [1,0,0,0,1,0|2,0,0]=4 3990 B11R1.172 OC(=O)OCCc1cc[nH]c1 Amb24070008 [1,0,0,0,1,0|2,0,0]=4 3991 B11R1.25 CCC(=O)CCc1cc[nH]c1 Amb18224290 [0,0,0,0,2,0|2,0,0]=4 3992 B11R1.25 CCC(=O)CCc1ccco1 Amb18177203 [0,0,0,0,2,0|2,0,0]=4 3993 B11R1.25 CNC(=O)CC[n]1cccc1 Amb18182791 [0,0,0,0,2,0|2,0,0]=4 3994 B11R1.25 COC(=N)CCc1ccc[s]1 Amb18563908 [0,0,0,0,2,0|2,0,0]=4 3995 B11R1.25 COC(=N)CCc1ccco1 Amb18065394 [0,0,0,0,2,0|2,0,0]=4 3996 B11R1.25 COC(=O)CC[n]1cccc1 Amb18799453 [0,0,0,0,2,0|1,0,0]=3 3997 B11R1.25 COC(=O)CCc1cc[n][nH]1 Amb24766211 [0,0,0,0,2,0|2,0,0]=4 3998 B11R1.25 COC(=O)CCc1cc[n]o1 Amb24762935 [0,0,0,0,2,0|2,0,0]=4 3999 B11R1.25 COC(=O)CCc1ccc[nH]1 Amb17617751 [0,0,0,0,2,0|1,0,0]=3 4000 B11R1.25 COC(=O)CCc1cnc[nH]1 Amb17617502 [0,0,0,0,2,0|2,0,0]=4 4001 B11R1.25 COC(=O)CCc1co[n]c1 Amb25382987 [0,0,0,0,2,0|2,0,0]=4 4002 B11R1.25 COC(=O)CCc1nccs1 Amb17334847 [0,0,0,0,2,0|2,0,0]=4 4003 B11R1.25 COC(=O)CN[n]1cccc1 Amb25379969 [0,0,0,0,2,0|2,0,0]=4 4004 B11R1.25 COC(=O)CSc1c[s]cc1 Amb24092455 [0,0,0,0,2,0|2,0,0]=4 4005 B11R1.25 COC(=O)NCc1cccs1 Amb17793916 [0,0,0,0,2,0|2,0,0]=4 4006 B11R1.25 COC(=O)NCc1cscc1 Amb10945325 [0,0,0,0,2,0|2,0,0]=4 4007 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [0,0,0,0,2,0|2,0,0]=4 4008 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [0,0,0,0,2,0|1,0,1]=4 4009 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [0,0,0,0,2,0|1,0,1]=4 4010 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [0,0,0,0,2,0|2,0,0]=4 4011 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [0,0,0,0,2,0|2,0,0]=4 4012 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [0,0,0,0,2,0|2,0,0]=4 4013 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [0,0,0,0,2,0|2,0,0]=4 4014 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [0,0,0,0,2,0|2,0,0]=4 4015 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [0,0,0,0,2,0|2,0,0]=4 4016 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [0,0,0,0,2,0|1,1,0]=4 4017 B11R1.40 COC(=N)Cc1cc[n]cc1 Amb18182737 [0,0,0,0,2,0|2,0,0]=4 4018 B11R1.40 COC(=N)Cc1ccc[n]c1 Amb18799364 [0,0,0,0,2,0|2,0,0]=4 4019 B11R1.40 COC(=N)Cc1cccc[n]1 Amb18179377 [0,0,0,0,2,0|2,0,0]=4 4020 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [0,0,0,0,2,0|1,0,0]=3 4021 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [0,0,0,0,2,0|1,0,0]=3 4022 B11R1.40 COC(=N)Nc1ccccc1 Amb24509579 [0,0,0,0,2,0|2,0,0]=4 4023 B11R1.40 COC(=O)Cc1c[n]c[n]c1 Amb25763089 [0,0,0,0,2,0|2,0,0]=4 4024 B11R1.40 COC(=O)Cc1cc[n][n]c1 Amb22405879 [0,0,0,0,2,0|2,0,0]=4 4025 B11R1.40 COC(=O)Cc1cc[n]c[n]1 Amb22500240 [0,0,0,0,2,0|2,0,0]=4 4026 B11R1.40 COC(=O)Cc1cc[n]cc1 Amb20240688 [0,0,0,0,2,0|1,0,0]=3 4027 B11R1.40 COC(=O)Cc1ccc[n]c1 Amb22497118 [0,0,0,0,2,0|1,0,0]=3 4028 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [0,0,0,0,2,0|1,0,0]=3 4029 B11R1.40 COC(=O)Cc1ncccn1 Amb17912090 [0,0,0,0,2,0|2,0,0]=4 4030 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [0,0,0,0,2,0|1,0,0]=3 4031 B11R1.40 COC(=O)Nc1ccccn1 Amb17860931 [0,0,0,0,2,0|2,0,0]=4 4032 B11R1.40 COC(=O)Nc1cccnc1 Amb2222993 [0,0,0,0,2,0|2,0,0]=4 4033 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [0,0,0,0,2,0|1,0,0]=3 4034 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [0,0,0,0,2,0|1,0,1]=4 4035 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [0,0,0,0,2,0|0,0,2]=4 4036 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [0,0,0,0,2,0|1,1,0]=4 4037 B11R1.40 CO\C(=N/c1ccccc1)\[O-] Amb16224823 [0,0,0,0,2,0|1,0,1]=4 4038 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [0,0,0,0,2,0|1,1,0]=4 4039 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [0,0,0,0,2,0|0,1,0]=3 4040 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [0,0,0,0,2,0|2,0,0]=4 4041 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [0,0,0,0,2,0|2,0,0]=4 4042 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [0,0,0,0,2,0|2,0,0]=4 4043 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [0,0,0,0,2,0|2,0,0]=4 4044 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [0,0,0,0,2,0|2,0,0]=4 4045 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [0,0,0,0,2,0|2,0,0]=4 4046 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [0,0,0,0,2,0|2,0,0]=4 4047 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [0,0,0,0,2,0|2,0,0]=4 4048 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [0,0,0,0,2,0|1,0,0]=3 4049 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [0,0,0,0,2,0|2,0,0]=4 4050 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [0,0,0,0,2,0|2,0,0]=4 4051 B15R1.962 C=CC(=O)OCCOCc1ccccc1 Amb25086031 [0,0,0,0,0,2|1,0,1]=4 4052 B15R1.962 CCC(=O)CCCOCc1ccccc1 Amb25849760 [0,0,0,0,0,2|1,0,0]=3 4053 B15R1.962 CCC(=O)NCCCOc1ccccc1 Amb2553294 [0,0,0,0,0,2|1,0,0]=3 4054 B15R1.962 CCC(=O)NCCCSc1ccccc1 Amb10611931 [0,0,0,0,0,2|1,0,0]=3 4055 B15R1.962 CCC(=O)NCCNCc1ccccc1 Amb24552653 [0,0,0,0,0,2|1,0,0]=3 4056 B15R1.962 CCC(=O)NCCOCc1ccccc1 Amb24555793 [0,0,0,0,0,2|1,0,0]=3 4057 B15R1.962 CCC(=O)NCCSCc1ccccc1 Amb10675828 [0,0,0,0,0,2|1,0,0]=3 4058 B15R1.962 CCC(=O)NOCCOc1ccccc1 Amb16793654 [0,0,0,0,0,2|2,0,0]=4 4059 B15R1.962 CCC(=O)OCCNCc1ccccc1 Amb18266491 [0,0,0,0,0,2|1,0,0]=3 4060 B15R1.962 CNC(=O)CCCNCc1ccccc1 Amb24362068 [0,0,0,0,0,2|1,0,0]=3 4061 B15R1.962 CNC(=O)CCNOCc1ccccc1 Amb25171109 [0,0,0,0,0,2|1,0,0]=3 4062 B15R1.962 CNC(=S)NCCSCc1ccccc1 Amb23099615 [0,0,0,0,0,2|1,1,0]=4 4063 B15R1.962 COC(=O)CCCNCc1ccccc1 Amb20668282 [0,0,0,0,0,2|0,0,0]=2 4064 B15R1.962 COC(=O)NOCCOc1ccccc1 Amb16793706 [0,0,0,0,0,2|1,0,0]=3 4065 B15R1.962 COC(=O)\C=C\CNCc1ccccc1 Amb24587117 [0,0,0,0,0,2|0,0,1]=3 4066 B15R1.962 COC(=O)\C=C\NOCc1ccccc1 Amb25825475 [0,0,0,0,0,2|0,0,2]=4 4067 B15R1.962 COC(C)CCCNCc1ccccc1 Amb24715257 [0,0,0,0,0,2|1,0,1]=4 4068 B15R1.962 ClCC(=O)NCCCOc1ccccc1 Amb17247972 [0,0,0,0,0,2|2,0,0]=4 4069 B15R1.962 ClCC(=O)NCCCSc1ccccc1 Amb1672011 [0,0,0,0,0,2|2,0,0]=4 4070 B15R1.962 ClCC(=O)NCCSCc1ccccc1 Amb1656481 [0,0,0,0,0,2|2,0,0]=4 4071 B15R1.962 NCC(=O)CCCOCc1ccccc1 Amb25854482 [0,0,0,0,0,2|2,0,0]=4 4072 B15R1.962 NCC(=O)NCCCOc1ccccc1 Amb24772755 [0,0,0,0,0,2|2,0,0]=4 4073 B15R1.962 O=C(CCl)NCCOCc1ccccc1 Amb24551228 [0,0,0,0,0,2|2,0,0]=4