"Identifier","RetentionTime","InChIKey1","ID","MolecularFormula","MonoisotopicMass","InChIKey2","InChI","XlogP3"
"10143739","14.7","MIABSAQIFYEDJP","EAX292501","C10H6F17O4P","543.9732","UHFFFAOYSA","InChI=1S/C10H6F17O4P/c11-3(12,1-2-31-32(28,29)30)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)9(23,24)10(25,26)27/h1-2H2,(H2,28,29,30)","4.6"
"105010","10.9","QCAWEPFNJXQPAN","EAX293501","C22H28N2O3","368.21","UHFFFAOYSA","InChI=1S/C22H28N2O3/c1-14-11-15(2)13-17(12-14)21(26)24(22(4,5)6)23-20(25)18-9-8-10-19(27-7)16(18)3/h8-13H,1-7H3,(H,23,25)","4.6"
"10507011","15.9","AYLOUUCBACYHAB","EAX291902","C10H4F17NO4S","556.959","UHFFFAOYSA","InChI=1S/C10H4F17NO4S/c11-3(12,5(15,16)7(19,20)9(23,24)25)4(13,14)6(17,18)8(21,22)10(26,27)33(31,32)28-1-2(29)30/h28H,1H2,(H,29,30)","4.8"
"107646","4.1","NWWZPOKUUAIXIW","EAX294101","C8H10ClN5O3S","291.0193","DHZHZOJOSA","InChI=1S/C8H10ClN5O3S/c1-12-4-17-5-13(8(12)11-14(15)16)3-6-2-10-7(9)18-6/h2H,3-5H2,1H3","1.5"
"107740","1.4","GCKLGRUZDXSATG","EAX027701","C6H11N5O","169.0964","UHFFFAOYSA","InChI=1S/C6H11N5O/c1-3(2)8-5-9-4(7)10-6(12)11-5/h3H,1-2H3,(H4,7,8,9,10,11,12)","-0.6"
"107901","11.7","ZMYFCFLJBGAQRS","EAX009501","C17H13ClFN3O","329.0726","IAGOWNOFSA","InChI=1S/C17H13ClFN3O/c18-15-4-2-1-3-14(15)16-17(23-16,9-22-11-20-10-21-22)12-5-7-13(19)8-6-12/h1-8,10-11,16H,9H2","3.2"
"108201","7.6","LMKQNTMFZLAJDV","EAX067101","C7H12ClN5","201.0781","UHFFFAOYSA","InChI=1S/C7H12ClN5/c1-7(2,3)13-6-11-4(8)10-5(9)12-6/h1-3H3,(H3,9,10,11,12,13)","2"
"10836","3.7","MYWUZJCMWCOHBA","EAX282901","C10H15N","149.1204","VIFPVBQESA","InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1","2.1"
"11419598","7.8","PXDNXJSDGQBLKS","EAX277801","C17H20N6O7S","452.1114","UHFFFAOYSA","InChI=1S/C17H20N6O7S/c1-23(2)15(25)11-6-5-10(18-9-24)7-12(11)31(27,28)22-17(26)21-16-19-13(29-3)8-14(20-16)30-4/h5-9H,1-4H3,(H,18,24)(H2,19,20,21,22,26)","0.5"
"114725","6.1","PRGQOPPDPVELEG","EAX270101","C15H14N2O3","270.1004","KBPBESRZSA","InChI=1S/C15H14N2O3/c16-15(20)17-11-7-3-1-5-9(11)13(18)14(19)10-6-2-4-8-12(10)17/h1-8,13-14,18-19H,(H2,16,20)/t13-,14-/m0/s1","0.3"
"115224","5.8","HOKKPVIRMVDYPB","EAX295401","C10H9ClN4S","252.0236","UHFFFAOYSA","InChI=1S/C10H9ClN4S/c11-9-2-1-8(5-13-9)6-15-3-4-16-10(15)14-7-12/h1-2,5H,3-4,6H2","2.2"
"115236","7.7","UTCJUUGCHWHUNI","EAX009902","C14H21NO5S","315.114","UHFFFAOYSA","InChI=1S/C14H21NO5S/c1-4-11-7-6-8-12(5-2)14(11)15(10-20-3)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)","1.8"
"11657899","10.8","KVEQCVKVIFQSGC","EAX274001","C13H9F6N5O4S","445.0279","UHFFFAOYSA","InChI=1S/C13H9F6N5O4S/c1-28-11-21-8(13(17,18)19)20-9(23-11)22-10(25)24-29(26,27)7-5-3-2-4-6(7)12(14,15)16/h2-5H,1H3,(H2,20,21,22,23,24,25)","3.1"
"11733192","16.1","WHZXTVOEGZRRJM","EAX273302","C10H2F16O2","457.9799","UPHRSURJSA","InChI=1S/C10H2F16O2/c11-2(1-3(27)28)4(12,13)5(14,15)6(16,17)7(18,19)8(20,21)9(22,23)10(24,25)26/h1H,(H,27,28)","5.1"
"11809635","5.2","NWJBWNIUGNXJGO","EAX286201","C13H16FN3O6","329.1023","RPULLILYSA","InChI=1S/C13H16FN3O6/c1-5-9(22-6(2)18)10(23-7(3)19)12(21-5)17-4-8(14)11(15)16-13(17)20/h4-5,9-10,12H,1-3H3,(H2,15,16,20)/t5-,9-,10+,12-/m1/s1","-0.7"
"125017","4.8","KYYIDSXMWOZKMP","EAX105301","C16H25NO2","263.1885","UHFFFAOYSA","InChI=1S/C16H25NO2/c1-17(2)12-15(13-6-8-14(18)9-7-13)16(19)10-4-3-5-11-16/h6-9,15,18-19H,3-5,10-12H2,1-2H3","2.6"
"12560","8.5","ULGZDMOVFRHVEP","EAX018901","C37H67NO13","733.4612","RWJQBGPGSA","InChI=1S/C37H67NO13/c1-14-25-37(10,45)30(41)20(4)27(39)18(2)16-35(8,44)32(51-34-28(40)24(38(11)12)15-19(3)47-34)21(5)29(22(6)33(43)49-25)50-26-17-36(9,46-13)31(42)23(7)48-26/h18-26,28-32,34,40-42,44-45H,14-17H2,1-13H3/t18-,19-,20+,21+,22-,23+,24+,25-,26+,28-,29+,30-,31?,32-,34+,35-,36-,37-/m1/s1","2.7"
"12654","4.9","HKAMKLBXTLTVCN","EAX066701","C8H15N5O","197.1271","UHFFFAOYSA","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5-2)13-8(12-6)14-3/h4-5H2,1-3H3,(H2,9,10,11,12,13)","1.8"
"13019211","6.7","MWWBDLRPMWTLRX","EAX028301","C8H15N5S","213.1048","UHFFFAOYSA","InChI=1S/C8H15N5S/c1-8(2,3)13-6-10-5(9)11-7(12-6)14-4/h1-4H3,(H3,9,10,11,12,13)","2.7"
"1302","10.2","CMWTZPSULFXXJA","EAX020201","C14H14O3","230.0943","UHFFFAOYSA","InChI=1S/C14H14O3/c1-9(14(15)16)10-3-4-12-8-13(17-2)6-5-11(12)7-10/h3-9H,1-2H3,(H,15,16)/t9-/m1/s1","3.3"
"134472","1.1","QMHAHUAQAJVBIW","EAX034101","C2H8N2O2S","124.0306","UHFFFAOYSA","InChI=1S/C2H8N2O2S/c1-4(2)7(3,5)6/h1-2H3,(H2,3,5,6)","-1.2"
"13450","8.5","IROINLKCQGIITA","EAX030601","C10H19N5S","241.1356","UHFFFAOYSA","InChI=1S/C10H19N5S/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","3.7"
"1355","5.2","VHFVKMTVMIZMIK","EAX281801","C10H13ClN2","196.0767","UHFFFAOYSA","InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2","1.7"
"13624","2.7","JWYUFVNJZUSCSM","EAX013801","C7H7N3","133.064","UHFFFAOYSA","InChI=1S/C7H7N3/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4H,(H3,8,9,10)","0.9"
"13754","9.5","VBLJFQYCTRKKKF","EAX270501","C12H21N2O4P","288.1239","UHFFFAOYSA","InChI=1S/C12H21N2O4P/c1-6-16-19(15,17-7-2)18-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3","2.1"
"13878","4.3","IVENSCMCQBJAKW","EAX028701","C5H8ClN5","173.0468","UHFFFAOYSA","InChI=1S/C5H8ClN5/c1-2-8-5-10-3(6)9-4(7)11-5/h2H2,1H3,(H3,7,8,9,10,11)","1.1"
"14052","9.6","AEUTYOVWOVBAKS","EAX278201","C10H24N2O2","204.1838","UWVGGRQHSA","InChI=1S/C10H24N2O2/c1-3-9(7-13)11-5-6-12-10(4-2)8-14/h9-14H,3-8H2,1-2H3/t9-,10?/m0/s1","-0.1"
"14211540","1","UWMXVJVTKRSOPW","EAX267001","C11H16N2O3","224.1161","UHFFFAOYSA","InChI=1S/C11H16N2O3/c12-6-9(14)7-16-10-3-1-8(2-4-10)5-11(13)15/h1-4,9,14H,5-7,12H2,(H2,13,15)/t9-/m0/s1","-1.2"
"14250578","12.1","FZTRDYSPWWJCOF","EAX292401","C8H6F13O4P","443.9796","UHFFFAOYSA","InChI=1S/C8H6F13O4P/c9-3(10,1-2-25-26(22,23)24)4(11,12)5(13,14)6(15,16)7(17,18)8(19,20)21/h1-2H2,(H2,22,23,24)","3.3"
"14371531","6.9","DFFWZNDCNBOKDI","EAX015001","C11H12O5","224.0685","KTKRTIGZSA","InChI=1S/C11H12O5/c12-7-3-6(11(15)16)4-8(13)9(7)10(14)5-1-2-5/h5-6,14H,1-4H2,(H,15,16)","0.2"
"14550408","18.1","ZDYYWMSLMLTXDM","EAX292201","C16H9F26O4P","789.9823","UHFFFAOYSA","InChI=1S/C16H9F26O4P/c17-5(18,7(21,22)9(25,26)11(29,30)13(33,34)15(37,38)39)1-3-45-47(43,44)46-4-2-6(19,20)8(23,24)10(27,28)12(31,32)14(35,36)16(40,41)42/h1-4H2,(H,43,44)","8.6"
"1486","9.1","OVSKIKFHRZPJSS","EAX026702","C8H6Cl2O3","219.9694","UHFFFAOYSA","InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)","2.8"
"14924483","7.4","MHCYOELBTPOBIU","EAX010002","C14H19NO4","265.1314","UHFFFAOYSA","InChI=1S/C14H19NO4/c1-4-10-7-6-8-11(5-2)12(10)15(9-19-3)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","2.9"
"15359","5.7","PXWUKZGIHQRDHL","EAX015701","C9H17N5O","211.1428","UHFFFAOYSA","InChI=1S/C9H17N5O/c1-5-10-7-12-8(11-6(2)3)14-9(13-7)15-4/h6H,5H2,1-4H3,(H2,10,11,12,13,14)","2.7"
"15390532","4.6","ADWTYURAFSWNSU","EAX295601","C9H10ClN3O","211.0512","UHFFFAOYSA","InChI=1S/C9H10ClN3O/c10-8-2-1-7(5-12-8)6-13-4-3-11-9(13)14/h1-2,5H,3-4,6H2,(H,11,14)","0.7"
"15466","1.7","NXFQWRWXEYTOTK","EAX012501","C5H8N4O","140.0698","UHFFFAOYSA","InChI=1S/C5H8N4O/c1-3-7-4(6)9-5(8-3)10-2/h1-2H3,(H2,6,7,8,9)","0.3"
"15530","9.3","NRXQIUSYPAHGNM","EAX008702","C7H3I2NO","370.8304","UHFFFAOYSA","InChI=1S/C7H3I2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","2"
"15531","8.3","UPMXNNIRAGDFEH","EAX002402","C7H3Br2NO","274.8581","UHFFFAOYSA","InChI=1S/C7H3Br2NO/c8-5-1-4(3-10)2-6(9)7(5)11/h1-2,11H","3.5"
"155385","5.6","HYHJOUPYTUBFIX","EAX066601","C11H13NO3","207.0895","UHFFFAOYSA","InChI=1S/C11H13NO3/c1-8(2)12(10(13)11(14)15)9-6-4-3-5-7-9/h3-8H,1-2H3,(H,14,15)","2"
"15546","5.2","WYKYKTKDBLFHCY","EAX008801","C10H8ClN3O","221.035","UHFFFAOYSA","InChI=1S/C10H8ClN3O/c11-9-8(12)6-13-14(10(9)15)7-4-2-1-3-5-7/h1-6H,12H2","0.8"
"15842091","7.5","OTKTUNJJKYTOFF","EAX010202","C14H19NO4","265.1314","UHFFFAOYSA","InChI=1S/C14H19NO4/c1-4-11-8-6-7-10(3)12(11)15(9-19-5-2)13(16)14(17)18/h6-8H,4-5,9H2,1-3H3,(H,17,18)","2.7"
"15842092","9.3","LNOOSYCKMKZOJB","EAX026501","C15H21NO4","279.1471","UHFFFAOYSA","InChI=1S/C15H21NO4/c1-5-12-8-6-7-10(2)13(12)16(11(3)9-20-4)14(17)15(18)19/h6-8,11H,5,9H2,1-4H3,(H,18,19)/t11-/m0/s1","2.5"
"16183","4","JHSPCUHPSIUQRB","EAX008501","C7H5Cl2NO","188.9748","UHFFFAOYSA","InChI=1S/C7H5Cl2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11)","0.8"
"16212161","4.6","LEZHOZPJYAQQNU","EAX295501","C10H11ClN4OS","270.0342","UVTDQMKNSA","InChI=1S/C10H11ClN4OS/c11-8-2-1-7(5-13-8)6-15-3-4-17-10(15)14-9(12)16/h1-2,5H,3-4,6H2,(H2,12,16)/b14-10-","1.3"
"16212221","5.9","BFSZJLBDHMMCAH","EAX066501","C11H15NO4S","257.0722","UHFFFAOYSA","InChI=1S/C11H15NO4S/c1-9(2)12(10-6-4-3-5-7-10)11(13)8-17(14,15)16/h3-7,9H,8H2,1-2H3,(H,14,15,16)","0.5"
"16212222","6.2","FFKNXXCOXIZLJD","EAX066401","C11H12FN1O3","225.0801","UHFFFAOYSA","InChI=1S/C11H12FNO3/c1-7(2)13(10(14)11(15)16)9-5-3-8(12)4-6-9/h3-7H,1-2H3,(H,15,16)","2.1"
"16212225","6","SZCMHDLOUVZYST","EAX066301","C11H14FNO4S","275.0628","UHFFFAOYSA","InChI=1S/C11H14FNO4S/c1-8(2)13(11(14)7-18(15,16)17)10-5-3-9(12)4-6-10/h3-6,8H,7H2,1-2H3,(H,15,16,17)","1.1"
"16248","10.4","YFBPRJGDJKVWAH","EAX293701","C11H15NO2S","225.0823","UHFFFAOYSA","InChI=1S/C11H15NO2S/c1-7-5-9(14-11(13)12-3)6-8(2)10(7)15-4/h5-6H,1-4H3,(H,12,13)","2.9"
"16553","4.4","NFMIMWNQWAWNDW","EAX027901","C8H15N5O","197.1277","UHFFFAOYSA","InChI=1S/C8H15N5O/c1-4-9-6-11-7(10-5(2)3)13-8(14)12-6/h5H,4H2,1-3H3,(H3,9,10,11,12,13,14)","0.1"
"16559","8.6","ZTMKADLOSYKWCA","EAX294901","C13H18N2O2","234.1368","UHFFFAOYSA","InChI=1S/C13H18N2O2/c16-12-10-7-4-8-11(10)14-13(17)15(12)9-5-2-1-3-6-9/h9H,1-8H2,(H,14,17)","1.7"
"168167","6.3","DQWIIKBKAIPUPY","EAX024501","C14H16N4O5S","352.0841","UHFFFAOYSA","InChI=1S/C14H16N4O5S/c1-9(19)15-10-4-6-11(7-5-10)24(20,21)18-14-16-12(22-2)8-13(17-14)23-3/h4-8H,1-3H3,(H,15,19)(H,16,17,18)","1.5"
"16854","8.3","CYESCLHCWJKRKM","EAX028901","C7H6Cl2N2O","203.9857","UHFFFAOYSA","InChI=1S/C7H6Cl2N2O/c8-5-2-1-4(3-6(5)9)11-7(10)12/h1-3H,(H3,10,11,12)","2.6"
"17448","3.5","YQIXRXMOJFQVBV","EAX066801","C7H13N5O","183.112","UHFFFAOYSA","InChI=1S/C7H13N5O/c1-3-8-5-10-6(9-4-2)12-7(13)11-5/h3-4H2,1-2H3,(H3,8,9,10,11,12,13)","-0.3"
"17520","5.1","DMSMPAJRVJJAGA","EAX030101","C7H5NOS","151.0092","UHFFFAOYSA","InChI=1S/C7H5NOS/c9-7-5-3-1-2-4-6(5)10-8-7/h1-4H,(H,8,9)","1.3"
"17521","4.9","FNCMBMZOZQAWJA","EAX295301","C11H15NO3S","241.0773","UHFFFAOYSA","InChI=1S/C11H15NO3S/c1-7-5-9(15-11(13)12-3)6-8(2)10(7)16(4)14/h5-6H,1-4H3,(H,12,13)","1.5"
"175967","6.2","KPUREKXXPHOJQT","EAX025801","C14H13NO7S","339.0407","UHFFFAOYSA","InChI=1S/C14H13NO7S/c1-23(21,22)8-5-6-9(10(7-8)15(19)20)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","0.7"
"17777","3.4","AJPIUNPJBFBUKK","EAX270601","C8H12N2O","152.095","UHFFFAOYSA","InChI=1S/C8H12N2O/c1-5(2)8-9-6(3)4-7(11)10-8/h4-5H,1-3H3,(H,9,10,11)","0.7"
"178565","11.4","NWUWYYSKZYIQAE","EAX293601","C18H28N2O3","320.21","LBAUFKAWSA","InChI=1S/C18H28N2O3/c1-11(2)16(20-18(22)23-12(3)4)17(21)19-14(6)15-9-7-13(5)8-10-15/h7-12,14,16H,1-6H3,(H,19,21)(H,20,22)/t14-,16?/m0/s1","3.7"
"179957","8.2","DVBDYPDVNRJKNJ","EAX006701","C14H19NO2","233.1416","UHFFFAOYSA","InChI=1S/C14H19NO2/c1-4-12-7-5-6-10(2)14(12)15-11(3)8-17-9-13(15)16/h5-7,11H,4,8-9H2,1-3H3","2.5"
"18134","16.9","CKRXVVGETMYFIO","EAX292102","C12H8F17NO4S","584.9903","UHFFFAOYSA","InChI=1S/C12H8F17NO4S/c1-2-30(3-4(31)32)35(33,34)12(28,29)10(23,24)8(19,20)6(15,16)5(13,14)7(17,18)9(21,22)11(25,26)27/h2-3H2,1H3,(H,31,32)","5.4"
"181502","5.1","OUSYWCQYMPDAEO","EAX000401","C10H9N3O","187.0746","UHFFFAOYSA","InChI=1S/C10H9N3O/c1-7-11-10(14)9(13-12-7)8-5-3-2-4-6-8/h2-6H,1H3,(H,11,12,14)","1"
"182167","8.6","DOULWWSSZVEPIN","EAX030401","C11H16N2O","192.1263","UHFFFAOYSA","InChI=1S/C11H16N2O/c1-8(2)9-4-6-10(7-5-9)13-11(14)12-3/h4-8H,1-3H3,(H2,12,13,14)","2.2"
"185831","8","ABBKOIZWGCVCKE","EAX028501","C10H14N2O","178.1106","UHFFFAOYSA","InChI=1S/C10H14N2O/c1-7(2)8-3-5-9(6-4-8)12-10(11)13/h3-7H,1-2H3,(H3,11,12,13)","2.3"
"18752","2.4","VGPYEHKOIGNJKV","EAX015601","C8H10N2O4S","230.0356","UHFFFAOYSA","InChI=1S/C8H10N2O4S/c1-14-8(11)10-15(12,13)7-4-2-6(9)3-5-7/h2-5H,9H2,1H3,(H,10,11)","-0.3"
"19113","8.5","IDQHRQQSSQDLTR","EAX029401","C8H8Cl2N2O","218.0014","UHFFFAOYSA","InChI=1S/C8H8Cl2N2O/c1-11-8(13)12-5-2-3-6(9)7(10)4-5/h2-4H,1H3,(H2,11,12,13)","2.9"
"19539","11.5","NXTDJHZGHOFSQG","EAX032601","C13H10O3","214.063","UHFFFAOYSA","InChI=1S/C13H10O3/c14-13(15)10-5-4-8-12(9-10)16-11-6-2-1-3-7-11/h1-9H,(H,14,15)","3.9"
"1983","2.2","RZVAJINKPMORJF","EAX024301","C8H9NO2","151.0633","UHFFFAOYSA","InChI=1S/C8H9NO2/c1-6(10)9-7-2-4-8(11)5-3-7/h2-5,11H,1H3,(H,9,10)","0.5"
"1988","11.7","VTNQPKFIQCLBDU","EAX010401","C14H20ClNO2","269.1177","UHFFFAOYSA","InChI=1S/C14H20ClNO2/c1-4-12-8-6-7-11(3)14(12)16(10-18-5-2)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3","3.2"
"2078","11.7","XCSGPAVHZFQHGE","EAX027401","C14H20ClNO2","269.1177","UHFFFAOYSA","InChI=1S/C14H20ClNO2/c1-4-11-7-6-8-12(5-2)14(11)16(10-18-3)13(17)9-15/h6-8H,4-5,9-10H2,1-3H3/i1D3,2D3,4D2,5D2,6D,7D,8D","3.5"
"2083","2","NDAUXUAQIAJITI","EAX285101","C13H21NO3","239.1521","UHFFFAOYSA","InChI=1S/C13H21NO3/c1-13(2,3)14-7-12(17)9-4-5-11(16)10(6-9)8-15/h4-6,12,14-17H,7-8H2,1-3H3/t12-/m1/s1","0.3"
"208898","11.5","ZQTNQVWKHCQYLQ","EAX285501","C31H44N2O5S","556.2971","UHFFFAOYSA","InChI=1S/C31H44N2O5S/c1-5-8-12-29-30(27-23-25(32-39(4,35)36)15-18-28(27)38-29)31(34)24-13-16-26(17-14-24)37-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23,32H,5-12,19-22H2,1-4H3","7.2"
"210326","13.7","MGOHCFMYLBAPRN","EAX070401","C23H32N2O4","400.2368","UHFFFAOYSA","InChI=1S/C23H32N2O4/c1-7-16-13-15(3)14-17(8-2)18(16)19-20(26)24-9-11-28-12-10-25(24)21(19)29-22(27)23(4,5)6/h13-14H,7-12H2,1-6H3","4.6"
"213013","10.5","WYEMLYFITZORAB","EAX293801","C18H12Cl2N2O","342.0327","UHFFFAOYSA","InChI=1S/C18H12Cl2N2O/c19-13-9-7-12(8-10-13)14-4-1-2-6-16(14)22-18(23)15-5-3-11-21-17(15)20/h1-11H,(H,22,23)","4.9"
"213021","5.3","WCXDHFDTOYPNIE","EAX298601","C10H11ClN4","222.0672","UHFFFAOYSA","InChI=1S/C10H11ClN4/c1-8(14-7-12)15(2)6-9-3-4-10(11)13-5-9/h3-5H,6H2,1-2H3","1.4"
"213027","4.9","PGOOBECODWQEAB","EAX293301","C6H8ClN5O2S","249.0087","UHFFFAOYSA","InChI=1S/C6H8ClN5O2S/c1-8-6(11-12(13)14)10-3-4-2-9-5(7)15-4/h2H,3H2,1H3,(H2,8,10,11)","1.2"
"2140","1.6","YVPYQUNUQOZFHG","EAX023901","C11H9I3N2O4","613.7697","UHFFFAOYSA","InChI=1S/C11H9I3N2O4/c1-3(17)15-9-6(12)5(11(19)20)7(13)10(8(9)14)16-4(2)18/h1-2H3,(H,15,17)(H,16,18)(H,19,20)","1.8"
"2151","2.6","RLFWWDJHLFCNIJ","EAX084501","C11H13N3O","203.1059","UHFFFAOYSA","InChI=1S/C11H13N3O/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9/h3-7H,12H2,1-2H3","0.1"
"21584515","8.8","IKCXDZCEWZARFL","EAX273401","C21H15N3O5","389.1012","VBKFSLOCSA","InChI=1S/C21H15N3O5/c1-27-12-16(21(25)26)15-7-3-5-9-18(15)29-20-10-19(23-13-24-20)28-17-8-4-2-6-14(17)11-22/h2-10,12-13H,1H3,(H,25,26)/b16-12+","3.4"
"2159","3.8","NTJOBXMMWNYJFB","EAX285201","C17H27N3O4S","369.1722","UHFFFAOYSA","InChI=1S/C17H27N3O4S/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21)","1.5"
"2160","8.6","KRMDCWKBEZIMAB","EAX282101","C20H23N","277.183","UHFFFAOYSA","InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3","5"
"21803","14","HRBKVYFZANMGRE","EAX295101","C7H7Cl3NO3PS","320.895","UHFFFAOYSA","InChI=1S/C7H7Cl3NO3PS/c1-12-15(16,13-2)14-7-5(9)3-4(8)6(10)11-7/h3H,1-2H3","4.3"
"2206","4.6","VEQOALNAAJBPNY","EAX033801","C11H12N2O","188.095","UHFFFAOYSA","InChI=1S/C11H12N2O/c1-9-8-11(14)13(12(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3/i2-1","0.4"
"22206","10.1","FZXISNSWEXTPMF","EAX028401","C9H16ClN5","229.1089","UHFFFAOYSA","InChI=1S/C9H16ClN5/c1-5-11-7-12-6(10)13-8(14-7)15-9(2,3)4/h5H2,1-4H3,(H2,11,12,13,14,15)","3.1"
"22286931","16.5","QNDHIRFIMVNHBN","EAX292002","C11H6F17NO4S","570.9746","UHFFFAOYSA","InChI=1S/C11H6F17NO4S/c1-29(2-3(30)31)34(32,33)11(27,28)9(22,23)7(18,19)5(14,15)4(12,13)6(16,17)8(20,21)10(24,25)26/h2H2,1H3,(H,30,31)","5"
"2242","4.8","IAOZJIPTCAWIRG","EAX277001","C14H18N2O5","294.1216","GHMZBOCLSA","InChI=1S/C14H18N2O5/c1-21-14(20)11(7-9-5-3-2-4-6-9)16-13(19)10(15)8-12(17)18/h2-6,10-11H,7-8,15H2,1H3,(H,16,19)(H,17,18)/t10-,11-/m0/s1","-2.7"
"2249","2","METKIMKYRPQLGS","EAX016901","C14H22N2O3","266.163","UHFFFAOYSA","InChI=1S/C14H22N2O3/c1-10(2)16-8-12(17)9-19-13-5-3-11(4-6-13)7-14(15)18/h3-6,10,12,16-17H,7-9H2,1-2H3,(H2,15,18)/i10-1","0.2"
"22563","5.6","DFWFIQKMSFGDCQ","EAX030901","C6H10ClN5","187.0625","UHFFFAOYSA","InChI=1S/C6H10ClN5/c1-3(2)9-6-11-4(7)10-5(8)12-6/h3H,1-2H3,(H3,8,9,10,11,12)/i8+1","1.5"
"2256","8.3","MXWJVTOOROXGIU","EAX028801","C8H14ClN5","215.0932","UHFFFAOYSA","InChI=1S/C8H14ClN5/c1-4-10-7-12-6(9)13-8(14-7)11-5(2)3/h5H,4H2,1-3H3,(H2,10,11,12,13,14)/i10+1","2.6"
"22673275","12.5","JWKXVHLIRTVXLD","EAX266902","C12H4Cl2F6N4","387.9717","UHFFFAOYSA","InChI=1S/C12H4Cl2F6N4/c13-5-1-4(11(15,16)17)2-6(14)9(5)24-10(22)8(12(18,19)20)7(3-21)23-24/h1-2H,22H2","4.6"
"23017","9.7","WCYYAQFQZQEUEN","EAX270402","C5H2Cl3NO","196.9202","UHFFFAOYSA","InChI=1S/C5H2Cl3NO/c6-2-1-3(7)5(10)9-4(2)8/h1H,(H,9,10)","3.2"
"2328","7.5","ZOMSMJKLGFBRBS","EAX025301","C10H12N2O3S","240.0563","UHFFFAOYSA","InChI=1S/C10H12N2O3S/c1-7(2)12-10(13)8-5-3-4-6-9(8)11-16(12,14)15/h3-7,11H,1-2H3","2.8"
"2340","4.6","GVGYEFKIHJTNQZ","EAX282301","C16H19NO4","289.1314","UHFFFAOYSA","InChI=1S/C16H19NO4/c1-17-11-7-8-12(17)14(15(18)19)13(9-11)21-16(20)10-5-3-2-4-6-10/h2-6,11-14H,7-9H2,1H3,(H,18,19)/t11?,12?,13-,14-/m0/s1","-0.3"
"23712","9.8","BZRUVKZGXNSXMB","EAX067001","C9H16ClN5","229.1094","UHFFFAOYSA","InChI=1S/C9H16ClN5/c1-4-6(3)12-9-14-7(10)13-8(15-9)11-5-2/h6H,4-5H2,1-3H3,(H2,11,12,13,14,15)/t6-/m0/s1","3.1"
"24743","9.2","WZJZMXBKUWKXTQ","EAX014401","C16H16N2O4","300.1105","UHFFFAOYSA","InChI=1S/C16H16N2O4/c1-2-21-15(19)18-13-9-6-10-14(11-13)22-16(20)17-12-7-4-3-5-8-12/h3-11H,2H2,1H3,(H,17,20)(H,18,19)","3.4"
"24744","9.5","IDOWTHOLJBTAFI","EAX009401","C16H16N2O4","300.1116","UHFFFAOYSA","InChI=1S/C16H16N2O4/c1-11-5-3-6-12(9-11)18-16(20)22-14-8-4-7-13(10-14)17-15(19)21-2/h3-10H,1-2H3,(H,17,19)(H,18,20)","3.6"
"2519","4","RYYVLZVUVIJVGH","EAX030301","C8H10N4O2","194.0804","UHFFFAOYSA","InChI=1S/C8H10N4O2/c1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2/h4H,1-3H3/i1-1","-0.1"
"2520","7.3","SGTNSNPWRIOYBX","EAX067401","C27H38N2O4","454.2832","UHFFFAOYSA","InChI=1S/C27H38N2O4/c1-20(2)27(19-28,22-10-12-24(31-5)26(18-22)33-7)14-8-15-29(3)16-13-21-9-11-23(30-4)25(17-21)32-6/h9-12,17-18,20H,8,13-16H2,1-7H3/t27-/m0/s1","3.8"
"2541","9.3","HTQMVQVXFRQIKW","EAX280401","C24H20N6O3","440.1597","UHFFFAOYSA","InChI=1S/C24H20N6O3/c1-2-33-24-25-20-9-5-8-19(23(31)32)21(20)30(24)14-15-10-12-16(13-11-15)17-6-3-4-7-18(17)22-26-28-29-27-22/h3-13H,2,14H2,1H3,(H,31,32)(H,26,27,28,29)","4.1"
"2554","7.8","FFGPTBGBLSHEPO","EAX019401","C15H12N2O","236.095","UHFFFAOYSA","InChI=1S/C15H12N2O/c16-15(18)17-13-7-3-1-5-11(13)9-10-12-6-2-4-8-14(12)17/h1-10H,(H2,16,18)","2.5"
"2555","6.3","ZRWWEEVEIOGMMT","EAX091601","C15H12N2O2","252.0899","UHFFFAOYSA","InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18)","1.3"
"26295","9.8","KGANAERDZBAECK","EAX032501","C13H12O2","200.0837","UHFFFAOYSA","InChI=1S/C13H12O2/c14-10-11-5-4-8-13(9-11)15-12-6-2-1-3-7-12/h1-9,14H,10H2","2.5"
"2678","9.3","ZKLPARSLTMPFCP","EAX277201","C21H25ClN2O3","388.1554","UHFFFAOYSA","InChI=1S/C21H25ClN2O3/c22-19-8-6-18(7-9-19)21(17-4-2-1-3-5-17)24-12-10-23(11-13-24)14-15-27-16-20(25)26/h1-9,21H,10-16H2,(H,25,26)/t21-/m0/s1","1.7"
"26879","2.9","HLFSDGLLUJUHTE","EAX285701","C11H12N2S","204.0721","SNVBAGLBSA","InChI=1S/C11H12N2S/c1-2-4-9(5-3-1)10-8-13-6-7-14-11(13)12-10/h1-5,10H,6-8H2/i14+3","1.8"
"27189","11.7","WXZVAROIGSFCFJ","EAX012001","C17H21NO2","271.1567","UHFFFAOYSA","InChI=1S/C17H21NO2/c1-4-18(5-2)17(19)13(3)20-16-12-8-10-14-9-6-7-11-15(14)16/h6-13H,4-5H2,1-3H3","3.4"
"2730","16","SBPBAQFWLVIOKP","EAX295001","C9H11Cl3NO3PS","348.9263","UHFFFAOYSA","InChI=1S/C9H11Cl3NO3PS/c1-3-14-17(18,15-4-2)16-9-7(11)5-6(10)8(12)13-9/h5H,3-4H2,1-2H3/i1D3,2D3,3D2,4D2","5.3"
"27375","8.2","JXCGFZXSOMJFOA","EAX027301","C10H13ClN2O","212.0711","UHFFFAOYSA","InChI=1S/C10H13ClN2O/c1-7-4-5-8(6-9(7)11)12-10(14)13(2)3/h4-6H,1-3H3,(H,12,14)","2.4"
"2764","4.5","MYSWGUAQZAJSOK","EAX027601","C17H18FN3O3","331.1332","UHFFFAOYSA","InChI=1S/C17H18FN3O3/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24/h7-10,19H,1-6H2,(H,23,24)","-1.1"
"27689","6.6","AMRQXHFXNZFDCH","EAX013601","C12H16N2O3","236.1155","UHFFFAOYSA","InChI=1S/C12H16N2O3/c1-3-13-11(15)9(2)17-12(16)14-10-7-5-4-6-8-10/h4-9H,3H2,1-2H3,(H,13,15)(H,14,16)","1.6"
"2771","6.6","WSEQXVZVJXJVFP","EAX290101","C20H21FN2O","324.1638","UHFFFAOYSA","InChI=1S/C20H21FN2O/c1-23(2)11-3-10-20(17-5-7-18(21)8-6-17)19-9-4-15(13-22)12-16(19)14-24-20/h4-9,12H,3,10-11,14H2,1-2H3/t20-/m0/s1","3.2"
"2797","10","TXCGAZHTZHNUAI","EAX020401","C10H11ClO3","214.0397","UHFFFAOYSA","InChI=1S/C10H11ClO3/c1-10(2,9(12)13)14-8-5-3-7(11)4-6-8/h3-6H,1-2H3,(H,12,13)","2.6"
"2812","8.8","VNFPBHJOKIVQEB","EAX032901","C22H17ClN2","344.108","UHFFFAOYSA","InChI=1S/C22H17ClN2/c23-21-14-8-7-13-20(21)22(25-16-15-24-17-25,18-9-3-1-4-10-18)19-11-5-2-6-12-19/h1-17H","5"
"2818","6.4","QZUDBNBUXVUHMW","EAX284101","C18H19ClN4","326.1298","UHFFFAOYSA","InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3/i6D,7D,8D2,9D2,12D","3.2"
"29029","6.7","KDLRVYVGXIQJDK","EAX065701","C18H33ClN2O5S","424.1799","NOWPCOIGSA","InChI=1S/C18H33ClN2O5S/c1-5-6-10-7-11(21(3)8-10)17(25)20-12(9(2)19)16-14(23)13(22)15(24)18(26-16)27-4/h9-16,18,22-24H,5-8H2,1-4H3,(H,20,25)/t9-,10+,11?,12+,13-,14+,15+,16?,18+/m0/s1","2.2"
"2907","6.3","CMSMOCZEIVJLDB","EAX257901","C7H15Cl2N2O2P","260.0248","UHFFFAOYSA","InChI=1S/C7H15Cl2N2O2P/c8-2-5-11(6-3-9)14(12)10-4-1-7-13-14/h1-7H2,(H,10,12)/i4D2,7D2","0.6"
"3000715","9","IUJDSEJGGMCXSG","EAX274202","C11H18N2O2S","242.1089","UHFFFAOYSA","InChI=1S/C11H18N2O2S/c1-4-6-7(3)11(5-2)8(14)12-10(16)13-9(11)15/h7H,4-6H2,1-3H3,(H2,12,13,14,15,16)/t7-/m1/s1","2.9"
"3007","3.5","KWTSXDURSIMDCE","EAX282201","C9H13N","135.1048","UHFFFAOYSA","InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3/i8-1","1.8"
"3016","10.1","AAOVKJBEBIDNHE","EAX262601","C16H13ClN2O","284.0716","UHFFFAOYSA","InChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3","3"
"3017","13","FHIVAFMUCKRCQO","EAX029301","C12H21N2O3PS","304.1011","UHFFFAOYSA","InChI=1S/C12H21N2O3PS/c1-6-15-18(19,16-7-2)17-11-8-10(5)13-12(14-11)9(3)4/h8-9H,6-7H2,1-5H3/i1D3,2D3,6D2,7D2","3.8"
"3022253","20.4","AFWOYEYXUDHGHF","EAX292301","C20H9F34O4P","989.9696","UHFFFAOYSA","InChI=1S/C20H9F34O4P/c21-5(22,7(25,26)9(29,30)11(33,34)13(37,38)15(41,42)17(45,46)19(49,50)51)1-3-57-59(55,56)58-4-2-6(23,24)8(27,28)10(31,32)12(35,36)14(39,40)16(43,44)18(47,48)20(52,53)54/h1-4H2,(H,55,56)","11.3"
"30231","7.2","ITVGXXMINPYUHD","EAX281401","C28H36O15","612.2054","CUVHLRMHSA","InChI=1S/C28H36O15/c1-11-21(34)23(36)25(38)27(40-11)43-26-24(37)22(35)19(10-29)42-28(26)41-13-8-16(32)20(17(33)9-13)14(30)5-3-12-4-6-18(39-2)15(31)7-12/h4,6-9,11,19,21-29,31-38H,3,5,10H2,1-2H3","-0.3"
"3030","7","IWEDIXLBFLAXBO","EAX027501","C8H6Cl2O3","219.9699","UHFFFAOYSA","InChI=1S/C8H6Cl2O3/c1-13-7-5(10)3-2-4(9)6(7)8(11)12/h2-3H,1H3,(H,11,12)","2.2"
"3031","8.5","YOYAIZYFCNQIRF","EAX008401","C7H3Cl2N","170.9643","UHFFFAOYSA","InChI=1S/C7H3Cl2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3H","2.7"
"3033","12.8","DCOPUUMXTXDBNB","EAX020101","C14H11Cl2NO2","295.0167","UHFFFAOYSA","InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)","4.4"
"3033888","2.4","DFJVUWAHTQPQCV","EAX273801","C13H22N4O4S","330.1362","MDWZMJQESA","InChI=1S/C13H22N4O4S/c1-14-13(8-16(18)19)15-6-7-22-10-12-5-4-11(21-12)9-17(2,3)20/h4-5,8,14-15H,6-7,9-10H2,1-3H3/b13-8+","-0.3"
"3033889","0.8","SKHXRNHSZTXSLP","EAX273701","C13H22N4O4S","330.1362","UKTHLTGXSA","InChI=1S/C13H22N4O4S/c1-14-13(9-17(18)19)15-6-7-22(20)10-12-5-4-11(21-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","0.2"
"3034285","9.9","WFDXOXNFNRHQEC","EAX008901","C22H17N3O5","403.1163","GHRIWEEISA","InChI=1S/C22H17N3O5/c1-27-13-17(22(26)28-2)16-8-4-6-10-19(16)30-21-11-20(24-14-25-21)29-18-9-5-3-7-15(18)12-23/h3-11,13-14H,1-2H3/b17-13+","3.7"
"30479","6.9","FOXFZRUHNHCZPX","EAX009001","C8H14N4OS","214.0883","UHFFFAOYSA","InChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3","1.7"
"30773","6.6","MZZBPDKVEFVLFF","EAX275901","C9H13ClN6","240.089","UHFFFAOYSA","InChI=1S/C9H13ClN6/c1-4-12-7-13-6(10)14-8(15-7)16-9(2,3)5-11/h4H2,1-3H3,(H2,12,13,14,15,16)","2.2"
"3078139","13.5","LGHZJDKSVUTELU","EAX266702","C12H4Cl2F6N4O2S","451.9336","UHFFFAOYSA","InChI=1S/C12H4Cl2F6N4O2S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)27(25,26)12(18,19)20/h1-2H,22H2","4.7"
"3082","5.2","MCWXGJITAZMZEV","EAX276101","C5H12NO3PS2","228.9996","UHFFFAOYSA","InChI=1S/C5H12NO3PS2/c1-6-5(7)4-12-10(11,8-2)9-3/h4H2,1-3H3,(H,6,7)","0.8"
"3120","8.9","XMTQQYYKAHVGBJ","EAX029201","C9H10Cl2N2O","232.0165","UHFFFAOYSA","InChI=1S/C9H10Cl2N2O/c1-13(2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)/i1D3,2D3","2.7"
"31645","5","YFGYUFNIOHWBOB","EAX271101","C11H18N4O2","238.143","UHFFFAOYSA","InChI=1S/C11H18N4O2/c1-7-8(2)12-10(14(3)4)13-9(7)17-11(16)15(5)6/h1-6H3/i5D3,6D3","1.7"
"32490","2.4","WZZLDXDUQPOXNW","EAX294501","C9H20N2O2","188.1525","UHFFFAOYSA","InChI=1S/C9H20N2O2/c1-4-8-13-9(12)10-6-5-7-11(2)3/h4-8H2,1-3H3,(H,10,12)","1.2"
"33344","3.7","DHNRXBZYEKSXIM","EAX028001","C4H4ClNOS","148.9702","UHFFFAOYSA","InChI=1S/C4H4ClNOS/c1-6-4(7)2-3(5)8-6/h2H,1H3","0.9"
"33360","10","IRCMYGHHKLLGHV","EAX011701","C13H18O5S","286.0869","UHFFFAOYSA","InChI=1S/C13H18O5S/c1-5-16-12-13(2,3)10-8-9(18-19(4,14)15)6-7-11(10)17-12/h6-8,12H,5H2,1-4H3","2.7"
"3339","15.7","YMTINGFKWWXKFG","EAX033601","C20H21ClO4","360.1128","UHFFFAOYSA","InChI=1S/C20H21ClO4/c1-13(2)24-19(23)20(3,4)25-17-11-7-15(8-12-17)18(22)14-5-9-16(21)10-6-14/h5-13H,1-4H3","5.2"
"33443","6.7","ZJMZZNVGNSWOOM","EAX066901","C10H19N5O","225.159","UHFFFAOYSA","InChI=1S/C10H19N5O/c1-5-7(3)12-9-13-8(11-6-2)14-10(15-9)16-4/h7H,5-6H2,1-4H3,(H2,11,12,13,14,15)","3.2"
"3352","12.6","JPMIIZHYYWMHDT","EAX030001","C11H19NOS","213.1182","UHFFFAOYSA","InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3","4.5"
"33528","11.6","JPMIIZHYYWMHDT","EAX030001","C11H19NOS","213.1182","UHFFFAOYSA","InChI=1S/C11H19NOS/c1-2-3-4-5-6-7-9-12-11(13)8-10-14-12/h8,10H,2-7,9H2,1H3","3.5"
"3365","5.3","RFHAOTPXVQNOHP","EAX032801","C13H12F2N6O","306.1041","UHFFFAOYSA","InChI=1S/C13H12F2N6O/c14-10-1-2-11(12(15)3-10)13(22,4-20-8-16-6-18-20)5-21-9-17-7-19-21/h1-3,6-9,22H,4-5H2","0.4"
"33741","4.9","TVYLLZQTGLZFBW","EAX256701","C16H25NO2","263.1885","ZBFHGGJFSA","InChI=1S/C16H25NO2/c1-17(2)12-14-7-4-5-10-16(14,18)13-8-6-9-15(11-13)19-3/h6,8-9,11,14,18H,4-5,7,10,12H2,1-3H3/i1-1","2.6"
"3385","1","GHASVSINZRGABV","EAX256601","C4H3FN2O2","130.0179","UHFFFAOYSA","InChI=1S/C4H3FN2O2/c5-2-1-6-4(9)7-3(2)8/h1H,(H2,6,7,8,9)/i6+1,7+1","-0.9"
"3386","9.2","RTHCYVBBDHJXIQ","EAX033401","C17H18F3NO","309.134","UHFFFAOYSA","InChI=1S/C17H18F3NO/c1-21-12-11-16(13-5-3-2-4-6-13)22-15-9-7-14(8-10-15)17(18,19)20/h2-10,16,21H,11-12H2,1H3/i1D3","4"
"3440","6.8","ZZUFCTLCJUWOSV","EAX260001","C12H11ClN2O5S","330.0077","UHFFFAOYSA","InChI=1S/C12H11ClN2O5S/c13-9-5-10(15-6-7-2-1-3-20-7)8(12(16)17)4-11(9)21(14,18)19/h1-5,15H,6H2,(H,16,17)(H2,14,18,19)","2"
"3446","3.6","UGJMXCAKCUNAIE","EAX256101","C9H17NO2","171.1259","UHFFFAOYSA","InChI=1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)","-1.1"
"3451347","4.9","MMSWXJSQCAEDLK","EAX265701","C15H23NO2","249.1729","UHFFFAOYSA","InChI=1S/C15H23NO2/c1-16-11-14(12-5-7-13(17)8-6-12)15(18)9-3-2-4-10-15/h5-8,14,16-18H,2-4,9-11H2,1H3","2.7"
"34536","1.3","OLAOYPRJVHUHCF","EAX034201","C12H11I3N2O5","643.7802","UHFFFAOYSA","InChI=1S/C12H11I3N2O5/c1-4(19)17-10-8(14)5(11(20)16-2-3-18)7(13)6(9(10)15)12(21)22/h18H,2-3H2,1H3,(H,16,20)(H,17,19)(H,21,22)","1.2"
"3501942","6.3","MKAFOJAJJMUXLW","EAX103401","C16H25NO2","263.1885","UHFFFAOYSA","InChI=1S/C16H25NO2/c1-17-12-15(16(18)10-4-3-5-11-16)13-6-8-14(19-2)9-7-13/h6-9,15,17-18H,3-5,10-12H2,1-2H3","3"
"36324","15.4","QXAITBQSYVNQDR","EAX010701","C19H23N3","293.1892","ZIOPAAQOSA","InChI=1S/C19H23N3/c1-14-6-8-18(16(3)10-14)20-12-22(5)13-21-19-9-7-15(2)11-17(19)4/h6-13H,1-5H3","5.5"
"36326","4.5","JIIOLEGNERQDIP","EAX033101","C10H14N2","162.1157","UHFFFAOYSA","InChI=1S/C10H14N2/c1-8-4-5-10(9(2)6-8)12-7-11-3/h4-7H,1-3H3,(H,11,12)","1.7"
"3639","2.2","JZUFKLXOESDKRF","EAX261001","C7H8ClN3O4S2","296.9645","UHFFFAOYSA","InChI=1S/C7H8ClN3O4S2/c8-4-1-5-7(2-6(4)16(9,12)13)17(14,15)11-3-10-5/h1-2,10-11H,3H2,(H2,9,12,13)","-0.1"
"36573","1.5","YGCFIWIQZPHFLU","EAX275602","C4H5NO4S","162.9939","UHFFFAOYSA","InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)","-0.3"
"36584","6.7","BCQMBFHBDZVHKU","EAX034601","C10H19N5O","225.1584","UHFFFAOYSA","InChI=1S/C10H19N5O/c1-6-11-7-12-8(15-10(2,3)4)14-9(13-7)16-5/h6H2,1-5H3,(H2,11,12,13,14,15)","3.1"
"36679","8.7","PUIYMUZLKQOUOZ","EAX028601","C12H18N2O","206.1414","UHFFFAOYSA","InChI=1S/C12H18N2O/c1-9(2)10-5-7-11(8-6-10)13-12(15)14(3)4/h5-9H,1-4H3,(H,13,15)/i3D3,4D3","2.9"
"3676","4.2","NNJVILVZKWQKPM","EAX257201","C14H22N2O","234.1732","UHFFFAOYSA","InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)","2.3"
"36867","13.3","LLLFASISUZUJEQ","EAX006901","C12H16ClNOS","257.0647","UHFFFAOYSA","InChI=1S/C12H16ClNOS/c1-3-14(4-2)12(15)16-9-10-7-5-6-8-11(10)13/h5-8H,3-4,9H2,1-2H3","3.4"
"3690","6.3","HOMGKSMUEGBAAB","EAX268301","C7H15Cl2N2O2P","260.0248","UHFFFAOYSA","InChI=1S/C7H15Cl2N2O2P/c8-2-4-10-14(12)11(6-3-9)5-1-7-13-14/h1-7H2,(H,10,12)","0.9"
"3715","12.9","CGIGDMFJXJATDK","EAX020701","C19H16ClNO4","357.0768","UHFFFAOYSA","InChI=1S/C19H16ClNO4/c1-11-15(10-18(22)23)16-9-14(25-2)7-8-17(16)21(11)19(24)12-3-5-13(20)6-4-12/h3-9H,10H2,1-2H3,(H,22,23)","4.3"
"3730","1.6","NTHXOOBQLCIOLC","EAX023101","C19H26I3N3O9","820.8803","UHFFFAOYSA","InChI=1S/C19H26I3N3O9/c1-8(29)25(4-11(32)7-28)17-15(21)12(18(33)23-2-9(30)5-26)14(20)13(16(17)22)19(34)24-3-10(31)6-27/h9-11,26-28,30-32H,2-7H2,1H3,(H,23,33)(H,24,34)","-3"
"3731","1.6","NJKDOADNQSYQEV","EAX024001","C17H22I3N3O8","776.8541","UHFFFAOYSA","InChI=1S/C17H22I3N3O8/c1-23(9(29)6-26)15-13(19)10(16(30)21-2-7(27)4-24)12(18)11(14(15)20)17(31)22-3-8(28)5-25/h7-8,24-28H,2-6H2,1H3,(H,21,30)(H,22,31)","-2.3"
"3734","1.2","XQZXYNRDCRIARQ","EAX024101","C17H22I3N3O8","776.8541","UHFFFAOYSA","InChI=1S/C17H22I3N3O8/c1-6(28)15(29)23-14-12(19)9(16(30)21-7(2-24)3-25)11(18)10(13(14)20)17(31)22-8(4-26)5-27/h6-8,24-28H,2-5H2,1H3,(H,21,30)(H,22,31)(H,23,29)","-2.4"
"3736","2.7","DGAIEPBNLOQYER","EAX024201","C18H24I3N3O8","790.8698","UHFFFAOYSA","InChI=1S/C18H24I3N3O8/c1-24(4-9(28)6-26)18(31)12-13(19)11(17(30)22-3-8(27)5-25)14(20)16(15(12)21)23-10(29)7-32-2/h8-9,25-28H,3-7H2,1-2H3,(H,22,30)(H,23,29)","-2.1"
"3749","9.2","YOSHYTLCDANDAN","EAX277401","C25H28N6O","428.2325","UHFFFAOYSA","InChI=1S/C25H28N6O/c1-2-3-10-22-26-25(15-6-7-16-25)24(32)31(22)17-18-11-13-19(14-12-18)20-8-4-5-9-21(20)23-27-29-30-28-23/h4-5,8-9,11-14H,2-3,6-7,10,15-17H2,1H3,(H,27,28,29,30)","4.1"
"37907","8.1","OWEGWHBOCFMBLP","EAX273901","C15H17ClN2O2","292.0979","UHFFFAOYSA","InChI=1S/C15H17ClN2O2/c1-15(2,3)13(19)14(18-9-8-17-10-18)20-12-6-4-11(16)5-7-12/h4-10,14H,1-3H3","3.7"
"3821","4.6","YQEZLKZALYSWHR","EAX282601","C13H16ClNO","237.092","UHFFFAOYSA","InChI=1S/C13H16ClNO/c1-15-13(9-5-4-8-12(13)16)10-6-2-3-7-11(10)14/h2-3,6-7,15H,4-5,8-9H2,1H3/i1-1","2.2"
"3825","9.6","DKYWVDODHFEZIM","EAX020501","C16H14O3","254.0943","UHFFFAOYSA","InChI=1S/C16H14O3/c1-11(16(18)19)13-8-5-9-14(10-13)15(17)12-6-3-2-4-7-12/h2-11H,1H3,(H,18,19)/t11-/m1/s1","3.1"
"3878","5.4","PYZRQGJRPPTADH","EAX267601","C9H7Cl2N5","255.0079","UHFFFAOYSA","InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16)","1.4"
"38854","4.9","VHCNQEUWZYOAEV","EAX005801","C10H10N4O","202.086","UHFFFAOYSA","InChI=1S/C10H10N4O/c1-7-12-13-9(10(15)14(7)11)8-5-3-2-4-6-8/h2-6H,11H2,1H3","0.7"
"39042","10.6","IIBYAHWJQTYFKB","EAX020901","C19H20ClNO4","361.1081","UHFFFAOYSA","InChI=1S/C19H20ClNO4/c1-19(2,18(23)24)25-16-9-3-13(4-10-16)11-12-21-17(22)14-5-7-15(20)8-6-14/h3-10H,11-12H2,1-2H3,(H,21,22)(H,23,24)","3.8"
"39722","9.1","SCCDDNKJYDZXMM","EAX070701","C13H18ClNO2","255.1021","UHFFFAOYSA","InChI=1S/C13H18ClNO2/c1-10-5-4-6-11(2)13(10)15(7-8-17-3)12(16)9-14/h4-6H,7-9H2,1-3H3","2.3"
"39912","13.6","HEFNNWSXXWATRW","EAX020301","C13H18O2","206.1307","JTQLQIEISA","InChI=1S/C13H18O2/c1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15/h4-7,9-10H,8H2,1-3H3,(H,14,15)/t10-/m1/s1","3.5"
"4044","14.5","HYYBABOKPJLUIN","EAX020801","C15H15NO2","241.1103","UHFFFAOYSA","InChI=1S/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)","5.1"
"4091","0.8","XZWYZXLIPXDOLR","EAX255001","C4H11N5","129.1014","UHFFFAOYSA","InChI=1S/C4H11N5/c1-9(2)4(7)8-3(5)6/h1-2H3,(H5,5,6,7,8)","-1.3"
"4095","8.4","USSIQXCVUWKGNF","EAX282801","C21H27NO","309.2093","UHFFFAOYSA","InChI=1S/C21H27NO/c1-5-20(23)21(16-17(2)22(3)4,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15,17H,5,16H2,1-4H3/t17-/m0/s1","3.9"
"4109","3.6","UHXUZOCRWCRNSJ","EAX294201","C5H10N2O2S","162.0463","QPJJXVBHSA","InChI=1S/C5H10N2O2S/c1-4(10-3)7-9-5(8)6-2/h1-3H3,(H,6,8)","0.6"
"4129546","5.7","DCASRSISIKYPDD","EAX285401","C15H14ClNO2S","307.0434","UHFFFAOYSA","InChI=1S/C15H14ClNO2S/c16-12-4-2-1-3-11(12)14(15(18)19)17-7-5-13-10(9-17)6-8-20-13/h1-4,6,8,14H,5,7,9H2,(H,18,19)","1.1"
"41428","10.3","REEQLXCGVXDJSQ","EAX294601","C7H4Cl3NO3","254.9257","UHFFFAOYSA","InChI=1S/C7H4Cl3NO3/c8-3-1-4(9)7(11-6(3)10)14-2-5(12)13/h1H,2H2,(H,12,13)","3"
"4168","4.3","TTWJBBZEZQICBI","EAX278101","C14H22ClN3O2","299.1401","UHFFFAOYSA","InChI=1S/C14H22ClN3O2/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3/h8-9H,4-7,16H2,1-3H3,(H,17,19)","2.6"
"4169","11.8","WVQBLGZPHOPPFO","EAX026801","C15H22ClNO2","283.1334","UHFFFAOYSA","InChI=1S/C15H22ClNO2/c1-5-13-8-6-7-11(2)15(13)17(14(18)9-16)12(3)10-19-4/h6-8,12H,5,9-10H2,1-4H3","3.1"
"4171","5.1","IUBSYMUCCVWXPE","EAX017201","C15H25NO3","267.1834","UHFFFAOYSA","InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3/t14-/m0/s1","1.9"
"4173","2.1","VAOCPAMSLUNLGC","EAX019701","C6H9N3O3","171.0644","UHFFFAOYSA","InChI=1S/C6H9N3O3/c1-5-7-4-6(9(11)12)8(5)2-3-10/h4,10H,2-3H2,1H3","0"
"41909","5.9","AHBXXEZLRFCZSF","EAX009301","C7H12N4O2","184.096","UHFFFAOYSA","InChI=1S/C7H12N4O2/c1-7(2,3)4-5(12)11(8)6(13)10-9-4/h8H2,1-3H3,(H,10,13)","-0.1"
"4235","4.5","YHXISWVBGDMDLQ","EAX267501","C13H17ClN2O2","268.0979","UHFFFAOYSA","InChI=1S/C13H17ClN2O2/c14-12-3-1-11(2-4-12)13(17)15-5-6-16-7-9-18-10-8-16/h1-4H,5-10H2,(H,15,17)","1.5"
"42546","4.5","VSOOBQALJVLTBH","EAX012601","C8H9NO4S","215.0252","UHFFFAOYSA","InChI=1S/C8H9NO4S/c1-13-8(10)6-4-2-3-5-7(6)14(9,11)12/h2-5H,1H3,(H2,9,11,12)","0.3"
"42614","5.6","XERJKGMBORTKEO","EAX011201","C7H10N4O3","198.0753","VZUCSPMQSA","InChI=1S/C7H10N4O3/c1-3-9-7(13)10-6(12)5(4-8)11-14-2/h3H2,1-2H3,(H2,9,10,12,13)","0.7"
"4272","9.9","HPNSFSBZBAHARI","EAX280801","C17H20O6","320.126","RUDMXATFSA","InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+","3.2"
"4284","8.6","MMOXZBCLCQITDF","EAX021301","C12H17NO","191.1305","UHFFFAOYSA","InChI=1S/C12H17NO/c1-4-13(5-2)12(14)11-8-6-7-10(3)9-11/h6-9H,4-5H2,1-3H3","2"
"42856","8.7","ZQEIXNIJLIKNTD","EAX013501","C15H21NO4","279.1465","UHFFFAOYSA","InChI=1S/C15H21NO4/c1-10-7-6-8-11(2)14(10)16(13(17)9-19-4)12(3)15(18)20-5/h6-8,12H,9H2,1-5H3","2.2"
"4296","5.9","KKIMDKMETPPURN","EAX281901","C11H13F3N2","230.1031","UHFFFAOYSA","InChI=1S/C11H13F3N2/c12-11(13,14)9-2-1-3-10(8-9)16-6-4-15-5-7-16/h1-3,8,15H,4-7H2","2.3"
"43234","13.1","STJLVHWMYQXCPB","EAX021201","C15H17Cl2N3O2","341.0692","UHFFFAOYSA","InChI=1S/C15H17Cl2N3O2/c1-2-3-12-7-21-15(22-12,8-20-10-18-9-19-20)13-5-4-11(16)6-14(13)17/h4-6,9-10,12H,2-3,7-8H2,1H3/t12-,15-/m1/s1","3.5"
"4369359","5.2","MFFMDFFZMYYVKS","EAX290301","C16H15F6N5O","407.1181","SECBINFHSA","InChI=1S/C16H15F6N5O/c17-10-6-12(19)11(18)4-8(10)3-9(23)5-14(28)26-1-2-27-13(7-26)24-25-15(27)16(20,21)22/h4,6,9H,1-3,5,7,23H2/t9-/m1/s1","0.7"
"441341","3","HPHUVLMMVZITSG","EAX256401","C8H14N2O2","170.1055","ZCFIWIBFSA","InChI=1S/C8H14N2O2/c1-2-6(8(9)12)10-5-3-4-7(10)11/h6H,2-5H2,1H3,(H2,9,12)/t6-/m1/s1","-0.3"
"444","5.8","SNPPWIUOZRMYNY","EAX280301","C13H18ClNO","239.1077","UHFFFAOYSA","InChI=1S/C13H18ClNO/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10/h5-9,15H,1-4H3/t9-/m1/s1","3.2"
"445434","10.2","ZYZCGGRZINLQBL","EAX299201","C49H74N10O12","994.5488","GWRQVWKTSA","InChI=1S/C49H74N10O12/c1-26(2)23-37-46(66)58-40(48(69)70)30(6)42(62)55-35(17-14-22-52-49(50)51)45(65)54-34(19-18-27(3)24-28(4)38(71-10)25-33-15-12-11-13-16-33)29(5)41(61)56-36(47(67)68)20-21-39(60)59(9)32(8)44(64)53-31(7)43(63)57-37/h11-13,15-16,18-19,24,26,28-31,34-38,40H,8,14,17,20-23,25H2,1-7,9-10H3,(H,53,64)(H,54,65)(H,55,62)(H,56,61)(H,57,63)(H,58,66)(H,67,68)(H,69,70)(H4,50,51,52)/b19-18+,27-24+/t28-,29-,30-,31+,34-,35-,36+,37-,38-,40+/m0/s1","2.3"
"446220","5","ZPUCINDJVBIVPJ","EAX281701","C17H21NO4","303.1471","LJISPDSOSA","InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12?,13-,14?,15?/m1/s1","2.3"
"449381","5.1","NENPYTRHICXVCS","EAX065901","C14H24N2O4","284.1736","YNEHKIRRSA","InChI=1S/C14H24N2O4/c1-4-10(5-2)20-12-7-9(14(18)19)6-11(15)13(12)16-8(3)17/h7,10-13H,4-6,15H2,1-3H3,(H,16,17)(H,18,19)/t11-,12+,13+/m0/s1","-1.9"
"45266826","4.3","YELGFTGWJGBAQU","EAX282701","C11H15NO","177.1154","UHFFFAOYSA","InChI=1S/C11H15NO/c1-8-4-6-10(7-5-8)11(13)9(2)12-3/h4-7,9,12H,1-3H3/i3+1D3","2"
"4539","4.4","OGJPXUAPXNRGGI","EAX023201","C16H18FN3O3","319.1332","UHFFFAOYSA","InChI=1S/C16H18FN3O3/c1-2-19-9-11(16(22)23)15(21)10-7-12(17)14(8-13(10)19)20-5-3-18-4-6-20/h7-9,18H,2-6H2,1H3,(H,22,23)/i1D3,2D2","-1"
"4616","9","ADIMAYPTOBDMTL","EAX274301","C15H11ClN2O2","286.0509","UHFFFAOYSA","InChI=1S/C15H11ClN2O2/c16-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)18-15(20)14(19)17-12/h1-8,15,20H,(H,17,19)/t15-/m0/s1","2.2"
"4632","12.1","DXGLGDHPHMLXJC","EAX023001","C14H12O3","228.0786","UHFFFAOYSA","InChI=1S/C14H12O3/c1-17-11-7-8-12(13(15)9-11)14(16)10-5-3-2-4-6-10/h2-9,15H,1H3","3.6"
"4679","6.6","IQPSEEYGBUAQFF","EAX064401","C16H15F2N3O4S","383.0751","UHFFFAOYSA","InChI=1S/C16H15F2N3O4S/c1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16/h3-7,15H,8H2,1-2H3,(H,20,21)","2.4"
"4909","5.4","DQMZLTXERSFNPB","EAX019501","C12H14N2O2","218.1055","UHFFFAOYSA","InChI=1S/C12H14N2O2/c1-2-12(9-6-4-3-5-7-9)10(15)13-8-14-11(12)16/h3-7H,2,8H2,1H3,(H,13,15)(H,14,16)","0.9"
"4928","6.7","ISEUFVQQFVOBCY","EAX013201","C10H19N5O","225.1584","UHFFFAOYSA","InChI=1S/C10H19N5O/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","3"
"4929","8.5","AAEVYOVXGOFMJO","EAX013301","C10H19N5S","241.1356","UHFFFAOYSA","InChI=1S/C10H19N5S/c1-6(2)11-8-13-9(12-7(3)4)15-10(14-8)16-5/h6-7H,1-5H3,(H2,11,12,13,14,15)","3.5"
"4931","8.6","MFOUDYKPLGXPGO","EAX070801","C11H14ClNO","211.0758","UHFFFAOYSA","InChI=1S/C11H14ClNO/c1-9(2)13(11(14)8-12)10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3","2.2"
"4937","9.9","WJNRPILHGGKWCK","EAX274101","C9H16N5Cl","229.1094","UHFFFAOYSA","InChI=1S/C9H16ClN5/c1-5(2)11-8-13-7(10)14-9(15-8)12-6(3)4/h5-6H,1-4H3,(H2,11,12,13,14,15)","2.9"
"49384","8.5","STEPQTYSZVCJPV","EAX026901","C14H16ClN3O","277.0976","UHFFFAOYSA","InChI=1S/C14H16ClN3O/c1-11-5-3-6-12(2)14(11)18(13(19)9-15)10-17-8-4-7-16-17/h3-8H,9-10H2,1-2H3","2.7"
"4946","6.6","AQHHHDLHHXJYJD","EAX017101","C16H21NO2","259.1572","UHFFFAOYSA","InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3/i12-1","3"
"5039","1.9","VMXUWOKSQNHOCA","EAX019601","C13H22N4O3S","314.1413","UKTHLTGXSA","InChI=1S/C13H22N4O3S/c1-14-13(9-17(18)19)15-6-7-21-10-12-5-4-11(20-12)8-16(2)3/h4-5,9,14-15H,6-8,10H2,1-3H3/b13-9+","0.3"
"50465","6.9","MEFQWPUMEMWTJP","EAX013401","C7H5Cl2FN2O3","253.9667","UHFFFAOYSA","InChI=1S/C7H5Cl2FN2O3/c8-3-5(11)4(9)7(12-6(3)10)15-1-2(13)14/h1H2,(H2,11,12)(H,13,14)","1.8"
"5143","2.5","CVHZOJJKTDOEJC","EAX281602","C7H5NO3S","182.999","UHFFFAOYSA","InChI=1S/C7H5NO3S/c9-7-5-3-1-2-4-6(5)12(10,11)8-7/h1-4H,(H,8,9)","0.9"
"5151089","5.6","OYTCZOJKXCTBHG","EAX034701","C9H17N5O","211.1433","UHFFFAOYSA","InChI=1S/C9H17N5O/c1-5-10-6-11-7(13-8(15)12-6)14-9(2,3)4/h5H2,1-4H3,(H3,10,11,12,13,14,15)","0.3"
"51605","12.6","HJUFTIJOISQSKQ","EAX294001","C17H19NO4","301.1314","UHFFFAOYSA","InChI=1S/C17H19NO4/c1-2-20-17(19)18-12-13-21-14-8-10-16(11-9-14)22-15-6-4-3-5-7-15/h3-11H,2,12-13H2,1H3,(H,18,19)","4.3"
"5215","2.2","SEEPANYCNGTZFQ","EAX017901","C10H10N4O2S","250.0524","UHFFFAOYSA","InChI=1S/C10H10N4O2S/c11-8-2-4-9(5-3-8)17(15,16)14-10-12-6-1-7-13-10/h1-7H,11H2,(H,12,13,14)","-0.1"
"5216","6.9","ODCWYMIRDDJXKW","EAX026201","C7H12ClN5","201.0776","UHFFFAOYSA","InChI=1S/C7H12ClN5/c1-3-9-6-11-5(8)12-7(13-6)10-4-2/h3-4H2,1-2H3,(H2,9,10,11,12,13)/i1D3,2D3,3D2,4D2","2.2"
"5253","1.6","ZBMZVLHSJCTVON","EAX017001","C12H20N2O3S","272.1195","UHFFFAOYSA","InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3","0.2"
"5280440","8.1","WBPYTXDJUQJLPQ","EAX018701","C46H77NO17","915.5191","VMXQISHHSA","InChI=1S/C46H77NO17/c1-13-33-30(22-58-45-42(57-12)41(56-11)37(52)26(5)60-45)18-23(2)14-15-31(49)24(3)19-29(16-17-48)39(25(4)32(50)20-34(51)62-33)64-44-38(53)36(47(9)10)40(27(6)61-44)63-35-21-46(8,55)43(54)28(7)59-35/h14-15,17-18,24-30,32-33,35-45,50,52-55H,13,16,19-22H2,1-12H3/t24-,25+,26-,27-,28+,29+,30-,32-,33-,35+,36-,37-,38-,39-,40-,41-,42-,43+,44+,45-,46-/m1/s1","1"
"5281037","6.3","OROAFUQRIXKEMV","EAX277601","C23H24N2O4S","424.1457","LDADJPATSA","InChI=1S/C23H24N2O4S/c1-2-3-6-21-24-14-19(12-18(23(28)29)13-20-5-4-11-30-20)25(21)15-16-7-9-17(10-8-16)22(26)27/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,26,27)(H,28,29)","4.5"
"5284371","2.8","OROGSEYTTFOCAN","EAX278001","C18H21NO3","299.1521","DNJOTXNNSA","InChI=1S/C18H21NO3/c1-19-8-7-18-11-4-5-13(20)17(18)22-16-14(21-2)6-3-10(15(16)18)9-12(11)19/h3-6,11-13,17,20H,7-9H2,1-2H3/t11-,12?,13-,17-,18-/m0/s1","1.1"
"5288826","1.1","BQJCRHHNABKAKU","EAX274401","C17H19NO3","285.1365","KBQPJGBKSA","InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11?,13?,16?,17-/m0/s1","0.8"
"52999","7.1","RSMUVYRMZCOLBH","EAX012801","C14H15N5O6S","381.0743","UHFFFAOYSA","InChI=1S/C14H15N5O6S/c1-8-15-12(18-14(16-8)25-3)17-13(21)19-26(22,23)10-7-5-4-6-9(10)11(20)24-2/h4-7H,1-3H3,(H2,15,16,17,18,19,21)","1.5"
"5323","5.7","ZZORFUFYDOWNEF","EAX018301","C12H14N4O4S","310.0736","UHFFFAOYSA","InChI=1S/C12H14N4O4S/c1-19-11-7-10(14-12(15-11)20-2)16-21(17,18)9-5-3-8(13)4-6-9/h3-7H,13H2,1-2H3,(H,14,15,16)","1.6"
"5327","3.9","ASWVTGNCAZCNNR","EAX018101","C12H14N4O2S","278.0837","UHFFFAOYSA","InChI=1S/C12H14N4O2S/c1-8-7-9(2)15-12(14-8)16-19(17,18)11-5-3-10(13)4-6-11/h3-7H,13H2,1-2H3,(H,14,15,16)","0.3"
"5329","4.6","JLKIGFTWXXRPMT","EAX029801","C10H11N3O3S","253.0521","UHFFFAOYSA","InChI=1S/C10H11N3O3S/c1-7-6-10(12-16-7)13-17(14,15)9-4-2-8(11)3-5-9/h2-6H,11H2,1H3,(H,12,13)","0.9"
"5336","2.9","GECHUMIMRBOMGK","EAX023401","C11H11N3O2S","249.0572","UHFFFAOYSA","InChI=1S/C11H11N3O2S/c12-9-4-6-10(7-5-9)17(15,16)14-11-3-1-2-8-13-11/h1-8H,12H2,(H,13,14)","0"
"5340","2.8","JNMRHUJNCSQMMB","EAX018501","C9H9N3O2S2","255.0136","UHFFFAOYSA","InChI=1S/C9H9N3O2S2/c10-7-1-3-8(4-2-7)16(13,14)12-9-11-5-6-15-9/h1-6H,10H2,(H,11,12)","0.1"
"5352621","6.5","AJRJPORIQGYFMT","EAX282501","C20H23N","277.183","RMOCHZDMSA","InChI=1S/C20H23N/c1-4-19-20(15-16(2)21(19)3,17-11-7-5-8-12-17)18-13-9-6-10-14-18/h4-14,16H,15H2,1-3H3","5.2"
"5360515","3.1","DQCKKXVULJGBQN","EAX283001","C20H23NO4","341.1627","XFWGSAIBSA","InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2","1.9"
"54687","9.2","TUZYXOIXSAXUGO","EAX285902","C23H36O7","424.2461","PZAWKZKUSA","InChI=1S/C23H36O7/c1-4-13(2)23(29)30-20-11-17(25)9-15-6-5-14(3)19(22(15)20)8-7-16(24)10-18(26)12-21(27)28/h5-6,9,13-14,16-20,22,24-26H,4,7-8,10-12H2,1-3H3,(H,27,28)","1.6"
"54778","9.4","KIEDNEWSYUYDSN","EAX013901","C12H14ClNO2","239.0708","UHFFFAOYSA","InChI=1S/C12H14ClNO2/c1-12(2)8-16-14(11(12)15)7-9-5-3-4-6-10(9)13/h3-6H,7-8H2,1-2H3","2.5"
"54841","8","VHGCDTVCOLNTBX","EAX284601","C17H21NO","255.1623","QGZVFWFLSA","InChI=1S/C17H21NO/c1-14-8-6-7-11-16(14)19-17(12-13-18-2)15-9-4-3-5-10-15/h3-11,17-18H,12-13H2,1-2H3/t17-/m1/s1","3.7"
"55185","5.9","MQTOSJVFKKJCRP","EAX019001","C38H72N2O12","748.5085","OHJWJPDZSA","InChI=1S/C38H72N2O12/c1-15-27-38(10,46)31(42)24(6)40(13)19-20(2)17-36(8,45)33(52-35-29(41)26(39(11)12)16-21(3)48-35)22(4)30(23(5)34(44)50-27)51-28-18-37(9,47-14)32(43)25(7)49-28/h20-33,35,41-43,45-46H,15-19H2,1-14H3/t20-,21?,22+,23-,24-,25?,26?,27-,28?,29?,30+,31-,32?,33+,35?,36-,37?,38-/m1/s1","4"
"5569","16.5","ZSDSQXJSNMTJDA","EAX012301","C13H16F3N3O4","335.1093","UHFFFAOYSA","InChI=1S/C13H16F3N3O4/c1-3-5-17(6-4-2)12-10(18(20)21)7-9(13(14,15)16)8-11(12)19(22)23/h7-8H,3-6H2,1-2H3","5.3"
"5578","3.8","IEDVJHCEMCRBQM","EAX019901","C14H18N4O3","290.1379","UHFFFAOYSA","InChI=1S/C14H18N4O3/c1-19-10-5-8(6-11(20-2)12(10)21-3)4-9-7-17-14(16)18-13(9)15/h5-7H,4H2,1-3H3,(H4,15,16,17,18)","0.9"
"5584","8.7","ZSCDBOWYZJWBIY","EAX286101","C20H26N2","294.2096","UHFFFAOYSA","InChI=1S/C20H26N2/c1-16(14-21(2)3)15-22-19-10-6-4-8-17(19)12-13-18-9-5-7-11-20(18)22/h4-11,16H,12-15H2,1-3H3","5.8"
"56069","9.9","LKJPYSCBVHEWIU","EAX280901","C18H14F4N2O4S","430.061","KRWDZBQOSA","InChI=1S/C18H14F4N2O4S/c1-17(26,10-29(27,28)14-6-3-12(19)4-7-14)16(25)24-13-5-2-11(9-23)15(8-13)18(20,21)22/h2-8,26H,10H2,1H3,(H,24,25)/t17-/m1/s1","2.3"
"5656","6.2","PNVNVHUZROJLTJ","EAX064501","C17H27NO2","277.2042","UHFFFAOYSA","InChI=1S/C17H27NO2/c1-18(2)13-16(17(19)11-5-4-6-12-17)14-7-9-15(20-3)10-8-14/h7-10,16,19H,4-6,11-13H2,1-3H3","2.9"
"5743","9.5","UREBDLICKHMUKA","EAX261201","C22H29FO5","392.1999","CXSFZGCWSA","InChI=1S/C22H29FO5/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,23)17(26)10-20(16,3)22(12,28)18(27)11-24/h6-7,9,12,15-17,24,26,28H,4-5,8,10-11H2,1-3H3/t12?,15-,16-,17?,19-,20-,21?,22-/m0/s1","1.9"
"5755","8","OIGNJSKKLXVSLS","EAX278301","C21H28O5","360.1937","VWUMJDOOSA","InChI=1S/C21H28O5/c1-19-7-5-13(23)9-12(19)3-4-14-15-6-8-21(26,17(25)11-22)20(15,2)10-16(24)18(14)19/h5,7,9,14-16,18,22,24,26H,3-4,6,8,10-11H2,1-2H3/t14?,15?,16?,18?,19?,20?,21-/m0/s1","1.6"
"5770","8.3","QEVHRUUCFGRFIF","EAX268201","C33H40N2O9","608.2734","MDEJGZGSSA","InChI=1S/C33H40N2O9/c1-38-19-7-8-20-21-9-10-35-16-18-13-27(44-32(36)17-11-25(39-2)30(41-4)26(12-17)40-3)31(42-5)28(33(37)43-6)22(18)15-24(35)29(21)34-23(20)14-19/h7-8,11-12,14,18,22,24,27-28,31,34H,9-10,13,15-16H2,1-6H3/t18-,22+,24-,27-,28+,31+/m1/s1","4"
"5833","10.2","LXMSZDCAJNLERA","EAX290201","C24H32O4S","416.2021","ZHYRCANASA","InChI=1S/C24H32O4S/c1-14(25)29-19-13-15-12-16(26)4-8-22(15,2)17-5-9-23(3)18(21(17)19)6-10-24(23)11-7-20(27)28-24/h12,17-19,21H,4-11,13H2,1-3H3/t17-,18-,19+,21+,22-,23-,24+/m0/s1","2.9"
"590774","6","CXWYCAYNZXSHTF","EAX011801","C11H12O5S","256.0405","UHFFFAOYSA","InChI=1S/C11H12O5S/c1-11(2)8-6-7(16-17(3,13)14)4-5-9(8)15-10(11)12/h4-6H,1-3H3","1.8"
"594330","2.2","XNSGCNYTNLWRKM","EAX069901","C5H6ClN3O","159.0199","UHFFFAOYSA","InChI=1S/C5H6ClN3O/c1-9-5(10)4(6)3(7)2-8-9/h2H,7H2,1H3","-0.2"
"6009","2.6","RMMXTBMQSGEXHJ","EAX070201","C13H17N3O","231.1372","UHFFFAOYSA","InChI=1S/C13H17N3O/c1-10-12(14(2)3)13(17)16(15(10)4)11-8-6-5-7-9-11/h5-9H,1-4H3/i2+1,3+1","1"
"60198","10.1","BFYIZQONLCFLEV","EAX066101","C20H24O2","296.1776","DAELLWKTSA","InChI=1S/C20H24O2/c1-12-10-14-15-4-5-18(22)20(15,3)9-7-16(14)19(2)8-6-13(21)11-17(12)19/h6,8,11,14-16H,1,4-5,7,9-10H2,2-3H3/t14-,15-,16-,19+,20-/m0/s1","3.1"
"60750","1","SDUQYLNIPVEERB","EAX260301","C9H11F2N3O4","263.0718","QPPQHZFASA","InChI=1S/C9H11F2N3O4/c10-9(11)6(16)4(3-15)18-7(9)14-2-1-5(12)13-8(14)17/h1-2,4,6-7,15-16H,3H2,(H2,12,13,17)","-1.5"
"60823","12.4","XUKUURHRXDUEBC","EAX281001","C33H35FN2O5","558.253","KAYWLYCHSA","InChI=1S/C33H35FN2O5/c1-21(2)31-30(33(41)35-25-11-7-4-8-12-25)29(22-9-5-3-6-10-22)32(23-13-15-24(34)16-14-23)36(31)18-17-26(37)19-27(38)20-28(39)40/h3-16,21,26-27,37-38H,17-20H2,1-2H3,(H,35,41)(H,39,40)","5"
"60846","11.2","ACWBQPMHZXGDFX","EAX258301","C24H29N5O3","435.227","QFIPXVFZSA","InChI=1S/C24H29N5O3/c1-4-5-10-21(30)29(22(16(2)3)24(31)32)15-17-11-13-18(14-12-17)19-8-6-7-9-20(19)23-25-27-28-26-23/h6-9,11-14,16,22H,4-5,10,15H2,1-3H3,(H,31,32)(H,25,26,27,28)","4.4"
"60954","13.6","NCDNCNXCDXHOMX","EAX258001","C37H48N6O5S2","720.3128","FDEOAKKQSA","InChI=1S/C37H48N6O5S2/c1-24(2)33(42-36(46)43(5)20-29-22-49-35(40-29)25(3)4)34(45)39-28(16-26-12-8-6-9-13-26)18-32(44)31(17-27-14-10-7-11-15-27)41-37(47)48-21-30-19-38-23-50-30/h6-15,19,22-25,28,31-33,44H,16-18,20-21H2,1-5H3,(H,39,45)(H,41,47)(H,42,46)","6"
"6112114","12.5","ZOTBXTZVPHCKPN","EAX015401","C18H19NO4","313.1309","HTXNQAPBSA","InChI=1S/C18H19NO4/c1-13-8-4-7-11-16(13)23-12-14-9-5-6-10-15(14)17(19-22-3)18(20)21-2/h4-11H,12H2,1-3H3","4.1"
"62020","14.4","NQLVQOSNDJXLKG","EAX007101","C14H21NOS","251.1349","UHFFFAOYSA","InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3","3.9"
"62097","8.4","WYVVKGNFXHOCQV","EAX030501","C8H12INO2","280.9913","UHFFFAOYSA","InChI=1S/C8H12INO2/c1-2-3-6-10-8(11)12-7-4-5-9/h2-3,6-7H2,1H3,(H,10,11)","2.1"
"62452","10.4","ZRKZFNZPJKEWPC","EAX278401","C12H27NO","201.2093","UHFFFAOYSA","InChI=1S/C12H27NO/c1-4-5-6-7-8-9-10-11-12-13(2,3)14/h4-12H2,1-3H3","4.2"
"62936","3.8","PUQIRTNPJRFRCZ","EAX069701","C14H21NO4","267.1471","UHFFFAOYSA","InChI=1S/C14H21NO4/c1-10(2)15-8-12(16)9-19-13-5-3-11(4-6-13)7-14(17)18/h3-6,10,12,15-16H,7-9H2,1-2H3,(H,17,18)","-1.5"
"6336","11.2","HZJKXKUJVSEEFU","EAX295701","C15H17ClN4","288.1142","UHFFFAOYSA","InChI=1S/C15H17ClN4/c1-2-3-8-15(9-17,10-20-12-18-11-19-20)13-4-6-14(16)7-5-13/h4-7,11-12H,2-3,8,10H2,1H3","2.9"
"6422843","13.4","HZRSNVGNWUDEFX","EAX277901","C19H18ClN3O4","387.0986","UHFFFAOYSA","InChI=1S/C19H18ClN3O4/c1-25-19(24)23(26-2)17-6-4-3-5-14(17)13-27-18-11-12-22(21-18)16-9-7-15(20)8-10-16/h3-12H,13H2,1-2H3/i7+1,8+1,9+1,10+1,15+1,16+1","4.1"
"6426848","7.7","HXAIQOCRALNGKB","EAX010302","C14H21NO5S","315.114","UHFFFAOYSA","InChI=1S/C14H21NO5S/c1-4-12-8-6-7-11(3)14(12)15(10-20-5-2)13(16)9-21(17,18)19/h6-8H,4-5,9-10H2,1-3H3,(H,17,18,19)","1.5"
"6426849","7.8","CIGKZVUEZXGYSV","EAX050201","C15H23NO5S","329.1297","UHFFFAOYSA","InChI=1S/C15H23NO5S/c1-5-13-8-6-7-11(2)15(13)16(12(3)9-21-4)14(17)10-22(18,19)20/h6-8,12H,5,9-10H2,1-4H3,(H,18,19,20)/t12-/m1/s1","1.4"
"6426850","6.7","YMYKMSAZEZQEER","EAX026001","C12H19NO5S2","321.0705","UHFFFAOYSA","InChI=1S/C12H19NO5S2/c1-8-6-19-10(3)12(8)13(9(2)5-18-4)11(14)7-20(15,16)17/h6,9H,5,7H2,1-4H3,(H,15,16,17)","0.9"
"6435415","5.2","DHSUYTOATWAVLW","EAX255501","C16H26N2O5S","358.1562","WFVMDLQDSA","InChI=1S/C16H26N2O5S/c1-16(2)8-10(16)13(19)18-12(15(22)23)6-4-3-5-7-24-9-11(17)14(20)21/h6,10-11H,3-5,7-9,17H2,1-2H3,(H,18,19)(H,20,21)(H,22,23)","-1"
"6439133","9.2","BPRHUIZQVSMCRT","EAX280201","C22H28FN3O6S","481.1683","YXWZHEERSA","InChI=1S/C22H28FN3O6S/c1-13(2)20-18(10-9-16(27)11-17(28)12-19(29)30)21(14-5-7-15(23)8-6-14)25-22(24-20)26(3)33(4,31)32/h5-10,13,16-17,27-28H,11-12H2,1-4H3,(H,29,30)/b10-9+/t16-,17-/m1/s1","1.6"
"6450826","11.5","CSWIKHNSBZVWNQ","EAX070001","C16H22ClNO2","295.1334","UHFFFAOYSA","InChI=1S/C16H22ClNO2/c1-4-20-11-10-18(15(19)12-17)16(13(2)3)14-8-6-5-7-9-14/h5-9H,4,10-12H2,1-3H3","3.5"
"6455361","2.9","NUISVCFZNCYUIM","EAX067201","C7H13N5O","183.112","UHFFFAOYSA","InChI=1S/C7H13N5O/c1-7(2,3)12-5-9-4(8)10-6(13)11-5/h1-3H3,(H4,8,9,10,11,12,13)","-0.4"
"64929","12.6","MQOBSOSZFYZQOK","EAX033701","C17H15ClO4","318.0659","UHFFFAOYSA","InChI=1S/C17H15ClO4/c1-17(2,16(20)21)22-14-9-5-12(6-10-14)15(19)11-3-7-13(18)8-4-11/h3-10H,1-2H3,(H,20,21)","3.9"
"64952","3.6","NJIZUWGMNCUKGU","EAX024801","C12H12N4O3S","292.063","UHFFFAOYSA","InChI=1S/C12H12N4O3S/c1-9(17)15-10-3-5-11(6-4-10)20(18,19)16-12-13-7-2-8-14-12/h2-8H,1H3,(H,15,17)(H,13,14,16)","-0.2"
"65028","7","VSZGPKBBMSAYNT","EAX065801","C16H28N2O4","312.2049","RRFJBIMHSA","InChI=1S/C16H28N2O4/c1-5-12(6-2)22-14-9-11(16(20)21-7-3)8-13(17)15(14)18-10(4)19/h9,12-15H,5-8,17H2,1-4H3,(H,18,19)","1.1"
"65280","5.5","GXPIUNZCALHVBA","EAX029901","C12H13N3O4S","295.0627","UHFFFAOYSA","InChI=1S/C12H13N3O4S/c1-8-7-12(14-19-8)15-20(17,18)11-5-3-10(4-6-11)13-9(2)16/h3-7H,1-2H3,(H,13,16)(H,14,15)","0.7"
"65743","3.7","OIAGWXKSCXPNNZ","EAX023601","C13H15N3O2","245.1164","UHFFFAOYSA","InChI=1S/C13H15N3O2/c1-9-12(14-10(2)17)13(18)16(15(9)3)11-7-5-4-6-8-11/h4-8H,1-3H3,(H,14,17)","0"
"65985","1.6","YLPBXIKWXNRACS","EAX289801","C20H28I3N3O9","834.896","UHFFFAOYSA","InChI=1S/C20H28I3N3O9/c1-25(3-10(31)7-29)19(34)12-14(21)13(20(35)26(2)4-11(32)8-30)16(23)17(15(12)22)24-18(33)9(5-27)6-28/h9-11,27-32H,3-8H2,1-2H3,(H,24,33)","-3"
"65999","9.2","RMMXLENWKUUMAY","EAX280501","C33H30N4O2","514.2369","UHFFFAOYSA","InChI=1S/C33H30N4O2/c1-4-9-30-35-31-21(2)18-24(32-34-27-12-7-8-13-28(27)36(32)3)19-29(31)37(30)20-22-14-16-23(17-15-22)25-10-5-6-11-26(25)33(38)39/h5-8,10-19H,4,9,20H2,1-3H3,(H,38,39)","6.9"
"6623","14","IISBACLAFKSPIT","EAX016301","C15H16O2","228.115","UHFFFAOYSA","InChI=1S/C15H16O2/c1-15(2,11-3-7-13(16)8-4-11)12-5-9-14(17)10-6-12/h3-10,16-17H,1-2H3/i1D3,2D3,3D,4D,5D,6D,7D,8D,9D,10D/hD2","3.3"
"66707","1.2","VILFVXYKHXVYAB","EAX065402","C10H8O6S2","287.9762","UHFFFAOYSA","InChI=1S/C10H8O6S2/c11-17(12,13)9-3-1-7-2-4-10(18(14,15)16)6-8(7)5-9/h1-6H,(H,11,12,13)(H,14,15,16)","-0.6"
"66855","4.5","LJKAKWDUZRJNPJ","EAX024701","C14H16N4O3S","320.0943","UHFFFAOYSA","InChI=1S/C14H16N4O3S/c1-9-8-10(2)16-14(15-9)18-22(20,21)13-6-4-12(5-7-13)17-11(3)19/h4-8H,1-3H3,(H,17,19)(H,15,16,18)","0.1"
"67183","4.1","KXNXWINFSDKMHD","EAX024901","C11H11N3O3S2","297.0242","UHFFFAOYSA","InChI=1S/C11H11N3O3S2/c1-8(15)13-9-2-4-10(5-3-9)19(16,17)14-11-12-6-7-18-11/h2-7H,1H3,(H,12,14)(H,13,15)","-0.1"
"6741","9.2","VHRSUDSXCMQTMA","EAX262101","C22H30O5","374.2093","PJHHCJLFSA","InChI=1S/C22H30O5/c1-12-8-14-15-5-7-22(27,18(26)11-23)21(15,3)10-17(25)19(14)20(2)6-4-13(24)9-16(12)20/h4,6,9,12,14-15,17,19,23,25,27H,5,7-8,10-11H2,1-3H3/t12-,14-,15-,17?,19?,20-,21-,22-/m0/s1","1.9"
"67542","9.3","PXUULQAPEKKVAH","EAX271502","C6HF11O2","313.9801","UHFFFAOYSA","InChI=1S/C6HF11O2/c7-2(8,1(18)19)3(9,10)4(11,12)5(13,14)6(15,16)17/h(H,18,19)","3.6"
"67818","11.1","ZWBAMYVPMDSJGQ","EAX271602","C7HF13O2","363.9769","UHFFFAOYSA","InChI=1S/C7HF13O2/c8-2(9,1(21)22)3(10,11)4(12,13)5(14,15)6(16,17)7(18,19)20/h(H,21,22)","4.3"
"67821","13.9","UZUFPBIDKMEQEQ","EAX271802","C9HF17O2","463.9705","UHFFFAOYSA","InChI=1S/C9HF17O2/c10-2(11,1(27)28)3(12,13)4(14,15)5(16,17)6(18,19)7(20,21)8(22,23)9(24,25)26/h(H,27,28)","5.6"
"67874","8.9","BAYGVMXZJBFEMB","EAX067302","C7H5F3O","162.0292","UHFFFAOYSA","InChI=1S/C7H5F3O/c8-7(9,10)5-1-3-6(11)4-2-5/h1-4,11H","2.8"
"68214","5.2","IRTZMJWVZQYURE","EAX270801","C13H17N3O3","263.127","UHFFFAOYSA","InChI=1S/C13H17N3O3/c1-10(17)15(4)16(11-8-6-5-7-9-11)13(19)12(18)14(2)3/h5-9H,1-4H3","0.9"
"69131857","14.7","PGMHPYRIXBRRQD","EAX066001","C18H24O2","272.1776","UHFFFAOYSA","InChI=1S/C18H24O2/c1-10-9-20-16(19)13-8-15-14(7-12(10)13)17(3,4)11(2)18(15,5)6/h7-8,10-11H,9H2,1-6H3","5"
"6915744","10.1","RXZBMPWDPOLZGW","EAX019201","C41H76N2O15","836.5246","XMRMVWPWSA","InChI=1S/C41H76N2O15/c1-15-29-41(10,49)34(45)24(4)31(42-53-21-52-17-16-50-13)22(2)19-39(8,48)36(58-38-32(44)28(43(11)12)18-23(3)54-38)25(5)33(26(6)37(47)56-29)57-30-20-40(9,51-14)35(46)27(7)55-30/h22-30,32-36,38,44-46,48-49H,15-21H2,1-14H3/t22-,23-,24+,25+,26-,27+,28+,29-,30+,32-,33+,34-,35+,36-,38+,39-,40-,41-/m1/s1","3.1"
"6916184","6.6","MKXZASYAUGDDCJ","EAX282401","C18H25NO","271.1936","NJAFHUGGSA","InChI=1S/C18H25NO/c1-19-10-9-18-8-4-3-5-15(18)17(19)11-13-6-7-14(20-2)12-16(13)18/h6-7,12,15,17H,3-5,8-11H2,1-2H3/t15?,17?,18-/m1/s1","3.4"
"6950","13","OWZPCEFYPSAJFR","EAX025702","C10H12N2O5","240.0746","UHFFFAOYSA","InChI=1S/C10H12N2O5/c1-3-6(2)8-4-7(11(14)15)5-9(10(8)13)12(16)17/h4-6,13H,3H2,1-2H3/t6-/m1/s1","3.6"
"71158","1","AFCGFAGUEYAMAO","EAX284801","C5H11NO4S","181.0409","UHFFFAOYSA","InChI=1S/C5H11NO4S/c1-5(7)6-3-2-4-11(8,9)10/h2-4H2,1H3,(H,6,7)(H,8,9,10)","-1.2"
"71485","4.4","BAQAVOSOZGMPRM","EAX070302","C12H19Cl3O8","396.0146","QBMZZYIRSA","InChI=1S/C12H19Cl3O8/c13-1-4-7(17)10(20)12(3-14,22-4)23-11-9(19)8(18)6(15)5(2-16)21-11/h4-11,16-20H,1-3H2/t4-,5-,6+,7-,8+,9-,10+,11-,12+/m1/s1","-1.5"
"7153","10.8","WNTGYJSOUMFZEP","EAX030802","C10H11ClO3","214.0397","UHFFFAOYSA","InChI=1S/C10H11ClO3/c1-6-5-8(11)3-4-9(6)14-7(2)10(12)13/h3-5,7H,1-2H3,(H,12,13)/t7-/m1/s1","3.1"
"7204","9.5","WHKUVVPPKQRRBV","EAX026102","C9H9ClO3","200.024","UHFFFAOYSA","InChI=1S/C9H9ClO3/c1-6-4-7(10)2-3-8(6)13-5-9(11)12/h2-4H,5H2,1H3,(H,11,12)","2.6"
"7207","11.9","LLWADFLAOKUBDR","EAX271002","C11H13ClO3","228.0553","UHFFFAOYSA","InChI=1S/C11H13ClO3/c1-8-7-9(12)4-5-10(8)15-6-2-3-11(13)14/h4-5,7H,2-3,6H2,1H3,(H,13,14)","3.6"
"7220","4.4","QRUDEWIWKLJBPS","EAX016601","C6H5N3","119.0483","UHFFFAOYSA","InChI=1S/C6H5N3/c1-2-4-6-5(3-1)7-9-8-6/h1-4H,(H,7,8,9)","1"
"7222","6.6","IOJUPLGTWVMSFF","EAX034301","C7H5NS","135.0143","UHFFFAOYSA","InChI=1S/C7H5NS/c1-2-4-7-6(3-1)8-5-9-7/h1-5H","2"
"72666","3.7","WSJBSKRPKADYRQ","EAX103801","C12H13N3O2","231.1008","UHFFFAOYSA","InChI=1S/C12H13N3O2/c1-9-11(13-8-16)12(17)15(14(9)2)10-6-4-3-5-7-10/h3-8H,1-2H3,(H,13,16)","0"
"73281","7.1","RTCOGUMHFFWOJV","EAX012901","C15H18N6O6S","410.1009","UHFFFAOYSA","InChI=1S/C15H18N6O6S/c1-21(2)13(22)9-6-5-7-16-12(9)28(24,25)20-15(23)19-14-17-10(26-3)8-11(18-14)27-4/h5-8H,1-4H3,(H2,17,18,19,20,23)","0.6"
"73665","12.2","TVLSRXXIMLFWEO","EAX009601","C15H16Cl3N3O2","375.0303","UHFFFAOYSA","InChI=1S/C15H16Cl3N3O2/c1-2-4-20(15(22)21-5-3-19-10-21)6-7-23-14-12(17)8-11(16)9-13(14)18/h3,5,8-10H,2,4,6-7H2,1H3","4.6"
"73674","7.2","AHTPATJNIAFOLR","EAX012401","C12H13N5O6S2","387.0307","UHFFFAOYSA","InChI=1S/C12H13N5O6S2/c1-6-13-10(16-12(14-6)23-3)15-11(19)17-25(20,21)7-4-5-24-8(7)9(18)22-2/h4-5H,1-3H3,(H2,13,14,15,16,17,19)","1.6"
"738302","7.5","UDCDOJQOXWCCSD","EAX034001","C9H14N2O2S","214.0776","UHFFFAOYSA","InChI=1S/C9H14N2O2S/c1-8-4-6-9(7-5-8)10-14(12,13)11(2)3/h4-7,10H,1-3H3","1.2"
"7464","5.2","LRTFPLFDLJYEKT","EAX005201","C9H13N","135.1048","UHFFFAOYSA","InChI=1S/C9H13N/c1-7(2)8-3-5-9(10)6-4-8/h3-7H,10H2,1-2H3","2.2"
"7533","3.6","HCAJEUSONLESMK","EAX281301","C6H13NO3S","179.0616","UHFFFAOYSA","InChI=1S/C6H13NO3S/c8-11(9,10)7-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,9,10)","0.6"
"7547","14.8","ICUTUKXCWQYESQ","EAX298801","C13H9Cl3N2O","313.978","UHFFFAOYSA","InChI=1S/C13H9Cl3N2O/c14-8-1-3-9(4-2-8)17-13(19)18-10-5-6-11(15)12(16)7-10/h1-7H,(H2,17,18,19)","5.3"
"75921","7.3","CXZGQIAOTKWCDB","EAX271402","C5HF9O2","263.9833","UHFFFAOYSA","InChI=1S/C5HF9O2/c6-2(7,1(15)16)3(8,9)4(10,11)5(12,13)14/h(H,15,16)","2.9"
"75994","1.2","IQXXEPZFOOTTBA","EAX282001","C11H16N2","176.1313","UHFFFAOYSA","InChI=1S/C11H16N2/c1-2-4-11(5-3-1)10-13-8-6-12-7-9-13/h1-5,12H,6-10H2","1.3"
"76857","7.3","PHWAJJWKNLWZGJ","EAX080402","C7H4Br2O3","293.8527","UHFFFAOYSA","InChI=1S/C7H4Br2O3/c8-4-1-3(7(11)12)2-5(9)6(4)10/h1-2,10H,(H,11,12)","3.3"
"77222","16.3","SIDINRCMMRKXGQ","EAX272202","C11HF21O2","563.9641","UHFFFAOYSA","InChI=1S/C11HF21O2/c12-2(13,1(33)34)3(14,15)4(16,17)5(18,19)6(20,21)7(22,23)8(24,25)9(26,27)10(28,29)11(30,31)32/h(H,33,34)","6.9"
"77797","17.1","CCEKAJIANROZEO","EAX273102","C10H6F17NO2S","526.9848","UHFFFAOYSA","InChI=1S/C10H6F17NO2S/c1-2-28-31(29,30)10(26,27)8(21,22)6(17,18)4(13,14)3(11,12)5(15,16)7(19,20)9(23,24)25/h28H,2H2,1H3","5.6"
"78441","6.3","QCDQDISRALTLNQ","EAX029601","C8H12N2O2S","200.0619","UHFFFAOYSA","InChI=1S/C8H12N2O2S/c1-10(2)13(11,12)9-8-6-4-3-5-7-8/h3-7,9H,1-2H3","0.9"
"8150","3.2","SBZXBUIDTXKZTM","EAX064301","C6H14O3","134.0943","UHFFFAOYSA","InChI=1S/C6H14O3/c1-7-3-5-9-6-4-8-2/h3-6H2,1-2H3","-0.4"
"84029","9.7","AGOYDEPGAOXOCK","EAX019101","C38H69NO13","747.4769","AVDMLEEESA","InChI=1S/C38H69NO13/c1-15-26-38(10,45)31(42)21(4)28(40)19(2)17-37(9,47-14)33(52-35-29(41)25(39(11)12)16-20(3)48-35)22(5)30(23(6)34(44)50-26)51-27-18-36(8,46-13)32(43)24(7)49-27/h19-27,29-33,35,41-43,45H,15-18H2,1-14H3","3.2"
"8420","5.2","KVBGVZZKJNLNJU","EAX065301","C10H8O3S","208.0194","UHFFFAOYSA","InChI=1S/C10H8O3S/c11-14(12,13)10-6-5-8-3-1-2-4-9(8)7-10/h1-7H,(H,11,12,13)","0.6"
"8427","10.7","MZHCENGPTKEIGP","EAX027002","C9H8O3Cl2","233.9845","UHFFFAOYSA","InChI=1S/C9H8Cl2O3/c1-5(9(12)13)14-8-3-2-6(10)4-7(8)11/h2-5H,1H3,(H,12,13)/t5-/m0/s1","3.4"
"8479","0.9","HVBSAKJJOYLTQU","EAX065201","C6H7NO3S","173.0147","UHFFFAOYSA","InChI=1S/C6H7NO3S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H,8,9,10)","-0.6"
"86102","12.8","PXMNMQRDXWABCY","EAX032701","C16H22ClN3O","307.1446","UHFFFAOYSA","InChI=1S/C16H22ClN3O/c1-15(2,3)16(21,10-20-12-18-11-19-20)9-8-13-4-6-14(17)7-5-13/h4-7,11-12,21H,8-10H2,1-3H3","3.7"
"86122","15","FROBCXTULYFHEJ","EAX012201","C22H22ClN3O5","443.1242","UHFFFAOYSA","InChI=1S/C22H22ClN3O5/c1-14(2)26-29-11-10-28-22(27)15(3)30-17-5-7-18(8-6-17)31-21-13-24-20-12-16(23)4-9-19(20)25-21/h4-9,12-13,15H,10-11H2,1-3H3/t15-/m1/s1","4.6"
"86132","11.5","UFNOUKDBUJZYDE","EAX008601","C15H18ClN3O","291.1133","UHFFFAOYSA","InChI=1S/C15H18ClN3O/c1-11(12-2-3-12)15(20,8-19-10-17-9-18-19)13-4-6-14(16)7-5-13/h4-7,9-12,20H,2-3,8H2,1H3","2.9"
"86137","5.7","NUPJIGQFXCQJBK","EAX293901","C15H19N3O4","305.1376","UHFFFAOYSA","InChI=1S/C15H19N3O4/c1-8(2)15(3)14(21)17-12(18-15)11-10(13(19)20)5-9(6-16-11)7-22-4/h5-6,8H,7H2,1-4H3,(H,19,20)(H,17,18,21)","0.9"
"86160","10.1","PUYXTUJWRLOUCW","EAX278901","C18H35NO2","297.2668","UHFFFAOYSA","InChI=1S/C18H35NO2/c1-6-12-19(7-2)13-16-14-20-18(21-16)10-8-15(9-11-18)17(3,4)5/h15-16H,6-14H2,1-5H3","4.2"
"86173","14.1","BQYJATMQXGBDHF","EAX293401","C19H17Cl2N3O3","405.0647","UHFFFAOYSA","InChI=1S/C19H17Cl2N3O3/c1-13-9-25-19(27-13,10-24-12-22-11-23-24)17-7-6-16(8-18(17)21)26-15-4-2-14(20)3-5-15/h2-8,11-13H,9-10H2,1H3","4"
"86298","10.8","QNBTYORWCCMPQP","EAX294401","C21H22ClNO4","387.1237","NBVRZTHBSA","InChI=1S/C21H22ClNO4/c1-25-19-8-5-16(13-20(19)26-2)18(15-3-6-17(22)7-4-15)14-21(24)23-9-11-27-12-10-23/h3-8,13-14H,9-12H2,1-2H3","3.9"
"86367","9.4","HAORKNGNJCEJBX","EAX014801","C14H15N3","225.126","UHFFFAOYSA","InChI=1S/C14H15N3/c1-10-9-13(11-7-8-11)17-14(15-10)16-12-5-3-2-4-6-12/h2-6,9,11H,7-8H2,1H3,(H,15,16,17)","3.1"
"86370","1.5","QHMTXANCGGJZRX","EAX294701","C10H11N5O","217.0964","WUXMJOGZSA","InChI=1S/C10H11N5O/c1-8-7-15(10(16)14-13-8)12-6-9-3-2-4-11-5-9/h2-6H,7H2,1H3,(H,14,16)","0"
"86398","10.7","MUJOIMFVNIBMKC","EAX016202","C12H6F2N2O2","248.0397","UHFFFAOYSA","InChI=1S/C12H6F2N2O2/c13-12(14)17-10-3-1-2-8(11(10)18-12)9-6-16-5-7(9)4-15/h1-3,5-6,16H","2.6"
"86418","4.8","YWTYJOPNNQFBPC","EAX270901","C9H10ClN5O2","255.0523","UHFFFAOYSA","InChI=1S/C9H10ClN5O2/c10-8-2-1-7(5-12-8)6-14-4-3-11-9(14)13-15(16)17/h1-2,5H,3-4,6H2,(H,11,13)/i3D2,4D2","0.8"
"86429","11.7","IANUJLZYFUDJIH","EAX070901","C14H13F4N3O2S","363.067","UHFFFAOYSA","InChI=1S/C14H13F4N3O2S/c1-8(2)21(10-5-3-9(15)4-6-10)11(22)7-23-13-20-19-12(24-13)14(16,17)18/h3-6,8H,7H2,1-2H3","3.6"
"86863","4.7","INGSNVSERUZOAK","EAX070101","C13H17NO2","219.1259","UHFFFAOYSA","InChI=1S/C13H17NO2/c15-13(16)12(10-6-2-1-3-7-10)11-8-4-5-9-14-11/h1-3,6-7,11-12,14H,4-5,8-9H2,(H,15,16)","-2.4"
"8705","5.8","LRUDIIUSNGCQKF","EAX016701","C7H7N3","133.064","UHFFFAOYSA","InChI=1S/C7H7N3/c1-5-2-3-6-7(4-5)9-10-8-6/h2-4H,1H3,(H,8,9,10)","1.4"
"8800","6.7","BMLIZLVNXIYGCK","EAX016101","C9H11ClN2O","198.0554","UHFFFAOYSA","InChI=1S/C9H11ClN2O/c1-12(2)9(13)11-8-5-3-7(10)4-6-8/h3-6H,1-2H3,(H,11,13)","1.9"
"91590","9.2","HDHLIWCXDDZUFH","EAX030201","C11H19N5S","253.1356","UHFFFAOYSA","InChI=1S/C11H19N5S/c1-11(2,3)16-9-13-8(12-7-5-6-7)14-10(15-9)17-4/h7H,5-6H2,1-4H3,(H2,12,13,14,15,16)","3.9"
"91650","7.6","ZLIBICFPKPWGIZ","EAX271201","C12H13N3","199.1109","UHFFFAOYSA","InChI=1S/C12H13N3/c1-9-8-10(2)14-12(13-9)15-11-6-4-3-5-7-11/h3-8H,1-2H3,(H,13,14,15)","2.9"
"91688","15.3","PORQOHRXAJJKGK","EAX034401","C11H17Cl2NOS","281.0402","UHFFFAOYSA","InChI=1S/C11H17Cl2NOS/c1-2-3-4-5-6-7-8-14-11(15)9(12)10(13)16-14/h2-8H2,1H3","5.1"
"91694","9.5","MGNFYQILYYYUBS","EAX295801","C19H31N","273.2457","UHFFFAOYSA","InChI=1S/C19H31N/c1-16(15-20-12-6-5-7-13-20)14-17-8-10-18(11-9-17)19(2,3)4/h8-11,16H,5-7,12-15H2,1-4H3","5.5"
"91701","10.9","YUVKUEAFAVKILW","EAX014701","C15H12F3NO4","327.0724","UHFFFAOYSA","InChI=1S/C15H12F3NO4/c1-9(14(20)21)22-11-3-5-12(6-4-11)23-13-7-2-10(8-19-13)15(16,17)18/h2-9H,1H3,(H,20,21)","2.9"
"91731","15.9","UZCGKGPEKUCDTF","EAX011902","C13H4Cl2F6N4O4","463.9514","UHFFFAOYSA","InChI=1S/C13H4Cl2F6N4O4/c14-6-1-4(12(16,17)18)3-22-11(6)23-9-7(24(26)27)2-5(13(19,20)21)8(15)10(9)25(28)29/h1-3H,(H,22,23)","6"
"91734","16.1","CJDWRQLODFKPEL","EAX293101","C14H6Cl2F4N2O2","379.9742","UHFFFAOYSA","InChI=1S/C14H6Cl2F4N2O2/c15-5-4-8(12(20)10(16)11(5)19)21-14(24)22-13(23)9-6(17)2-1-3-7(9)18/h1-4H,(H2,21,22,23,24)","4.9"
"91735","14.4","WYEHFWKAOXOVJD","EAX011601","C19H11F5N2O2","394.0735","UHFFFAOYSA","InChI=1S/C19H11F5N2O2/c20-12-6-7-16(15(21)10-12)26-17(27)14-5-2-8-25-18(14)28-13-4-1-3-11(9-13)19(22,23)24/h1-10H,(H,26,27)","4.6"
"91744","10","JLYFCTQDENRSOL","EAX025401","C12H18ClNO2S","275.0741","UHFFFAOYSA","InChI=1S/C12H18ClNO2S/c1-8-7-17-10(3)12(8)14(11(15)5-13)9(2)6-16-4/h7,9H,5-6H2,1-4H3","2.6"
"91760","6.8","PQTBTIFWAXVEPB","EAX029001","C14H13ClO5S","328.0167","UHFFFAOYSA","InChI=1S/C14H13ClO5S/c1-21(19,20)8-5-6-9(10(15)7-8)14(18)13-11(16)3-2-4-12(13)17/h5-7,13H,2-4H2,1H3","1.5"
"91773","12.4","QYPNKSZPJQQLRK","EAX295201","C22H28N2O2","352.2151","UHFFFAOYSA","InChI=1S/C22H28N2O2/c1-7-17-8-10-18(11-9-17)20(25)23-24(22(4,5)6)21(26)19-13-15(2)12-16(3)14-19/h8-14H,7H2,1-6H3,(H,23,25)","3.9"
"91779","7.9","MEFOUWRMVYJCQC","EAX013001","C14H17N5O7S2","431.0569","UHFFFAOYSA","InChI=1S/C14H17N5O7S2/c1-4-27(21,22)9-6-5-7-15-12(9)28(23,24)19-14(20)18-13-16-10(25-2)8-11(17-13)26-3/h5-8H,4H2,1-3H3,(H2,16,17,18,19,20)","0.7"
"9212","11","LCGTWRLJTMHIQZ","EAX099201","C14H11N","193.0891","UHFFFAOYSA","InChI=1S/C14H11N/c1-3-7-13-11(5-1)9-10-12-6-2-4-8-14(12)15-13/h1-10,15H","4"
"92299","11.7","RJKCKKDSSSRYCB","EAX025501","C15H23NO","233.1774","UHFFFAOYSA","InChI=1S/C15H23NO/c1-12(2)16(14(17)15(3,4)5)11-13-9-7-6-8-10-13/h6-10,12H,11H2,1-5H3","3.4"
"92421","8.9","RVKCCVTVZORVGD","EAX015101","C13H16O5","252.0992","QXMHVHEDSA","InChI=1S/C13H16O5/c1-2-18-13(17)8-5-9(14)11(10(15)6-8)12(16)7-3-4-7/h7-8,16H,2-6H2,1H3","0.9"
"9294","2.9","KWGRBVOPPLSCSI","EAX275801","C10H15NO","165.1154","WPRPVWTQSA","InChI=1S/C10H15NO/c1-8(11-2)10(12)9-6-4-3-5-7-9/h3-8,10-12H,1-2H3/t8-,10-/m1/s1/i2D3","0.9"
"93168","6.3","WLOBUUJURNEQCL","EAX263701","C17H26N2O2","290.1994","UHFFFAOYSA","InChI=1S/C17H26N2O2/c1-13(2)17(12-18,9-6-10-19-3)14-7-8-15(20-4)16(11-14)21-5/h7-8,11,13,19H,6,9-10H2,1-5H3","1.4"
"93365","9.4","RYAUSSKQMZRMAI","EAX014601","C20H33NO","303.2557","ALOPSCKCSA","InChI=1S/C20H33NO/c1-15(12-21-13-16(2)22-17(3)14-21)11-18-7-9-19(10-8-18)20(4,5)6/h7-10,15-17H,11-14H2,1-6H3","5.2"
"9411","7","CTSLUCNDVMMDHG","EAX026601","C9H13BrN2O2","260.0155","UHFFFAOYSA","InChI=1S/C9H13BrN2O2/c1-4-5(2)12-8(13)7(10)6(3)11-9(12)14/h5H,4H2,1-3H3,(H,11,14)","2.1"
"9502","10","XKJMBINCVNINCA","EAX016001","C9H10Cl2N2O2","248.0114","UHFFFAOYSA","InChI=1S/C9H10Cl2N2O2/c1-13(15-2)9(14)12-6-3-4-7(10)8(11)5-6/h3-5H,1-2H3,(H,12,14)","3.2"
"9554","12.6","SNGREZUHAYWORS","EAX271702","C8HF15O2","413.9737","UHFFFAOYSA","InChI=1S/C8HF15O2/c9-2(10,1(24)25)3(11,12)4(13,14)5(15,16)6(17,18)7(19,20)8(21,22)23/h(H,24,25)","4.9"
"9555","15.2","PCIUEQPBYFRTEM","EAX272002","C10HF19O2","513.9673","UHFFFAOYSA","InChI=1S/C10HF19O2/c11-2(12,1(30)31)3(13,14)4(15,16)5(17,18)6(19,20)7(21,22)8(23,24)9(25,26)10(27,28)29/h(H,30,31)","6.3"
"95827","1.3","FEWPCPCEGBPTAL","EAX069801","C4H4ClN3O","145.0043","UHFFFAOYSA","InChI=1S/C4H4ClN3O/c5-3-2(6)1-7-8-4(3)9/h1H,(H3,6,8,9)","-0.3"
"9777","5.1","YPJUNDFVDDCYIH","EAX271302","C4HF7O2","213.9865","UHFFFAOYSA","InChI=1S/C4HF7O2/c5-2(6,1(12)13)3(7,8)4(9,10)11/h(H,12,13)","2.2"
"9795857","6.3","SUQHIQRIIBKNOR","EAX265801","C15H23NO2","249.1729","UHFFFAOYSA","InChI=1S/C15H23NO2/c1-18-13-7-5-12(6-8-13)14(11-16)15(17)9-3-2-4-10-15/h5-8,14,17H,2-4,9-11,16H2,1H3","2.5"
"9810996","9","HLIAVLHNDJUHFG","EAX281501","C20H30N2O5","378.2155","HOTGVXAUSA","InChI=1S/C20H30N2O5/c1-20(2,3)10-11-21-15(13-17(23)24)18(25)22-16(19(26)27-4)12-14-8-6-5-7-9-14/h5-9,15-16,21H,10-13H2,1-4H3,(H,22,25)(H,23,24)/t15-,16-/m1/s1","-0.1"
"9834513","3.9","RLQJEEJISHYWON","EAX294301","C9H6F3N3O","229.0463","UHFFFAOYSA","InChI=1S/C9H6F3N3O/c10-9(11,12)7-1-3-14-5-6(7)8(16)15-4-2-13/h1,3,5H,4H2,(H,15,16)","0.8"
"9871558","1.7","FIRDBEQIJQERSE","EAX264901","C9H10F2N2O5","264.0558","QPPQHZFASA","InChI=1S/C9H10F2N2O5/c10-9(11)6(16)4(3-14)18-7(9)13-2-1-5(15)12-8(13)17/h1-2,4,6-7,14,16H,3H2,(H,12,15,17)/t4-,6-,7-/m0/s1","-1.3"
"9953940","13","FQXWEKADCSXYOC","EAX266801","C12H4Cl2F6N4S","419.9438","UHFFFAOYSA","InChI=1S/C12H4Cl2F6N4S/c13-5-1-4(11(15,16)17)2-6(14)8(5)24-10(22)9(7(3-21)23-24)25-12(18,19)20/h1-2H,22H2","5.5"