@relation QSAR-Dataset-weka.filters.unsupervised.instance.NonSparseToSparse @attribute MOLECULE_CHEMBL_ID {CHEMBL81269,CHEMBL311230,CHEMBL81755,CHEMBL80029,CHEMBL81133,CHEMBL420031,CHEMBL311931,CHEMBL420762,CHEMBL314344,CHEMBL420216,CHEMBL310416,CHEMBL312036,CHEMBL314908,CHEMBL86667,CHEMBL316093,CHEMBL86936,CHEMBL89177,CHEMBL89015,CHEMBL330510,CHEMBL313451,CHEMBL86577,CHEMBL87455,CHEMBL87887,CHEMBL87351,CHEMBL432375,CHEMBL411,CHEMBL380579,CHEMBL245086,CHEMBL576147,CHEMBL276711,CHEMBL24781,CHEMBL24526,CHEMBL100447,CHEMBL100893,CHEMBL103196,CHEMBL101187,CHEMBL320462,CHEMBL317919,CHEMBL102311,CHEMBL100069,CHEMBL430676,CHEMBL316849,CHEMBL440147,CHEMBL443498,CHEMBL432009,CHEMBL320416,CHEMBL430841,CHEMBL318392,CHEMBL105961,CHEMBL106229,CHEMBL321561,CHEMBL319433,CHEMBL318083,CHEMBL432973,CHEMBL107058,CHEMBL326225,CHEMBL319636,CHEMBL104839,CHEMBL106938,CHEMBL317243,CHEMBL106293,CHEMBL421039,CHEMBL32404,CHEMBL31065,CHEMBL283894,CHEMBL281243,CHEMBL296908,CHEMBL49322,CHEMBL295014,CHEMBL49429,CHEMBL297293,CHEMBL60954,CHEMBL306645,CHEMBL306970,CHEMBL418890,CHEMBL68085,CHEMBL307483,CHEMBL165670,CHEMBL360648,CHEMBL363910,CHEMBL196478,CHEMBL197793,CHEMBL196603,CHEMBL381248,CHEMBL198931,CHEMBL372766,CHEMBL424663,CHEMBL196737,CHEMBL198446,CHEMBL194970,CHEMBL197616,CHEMBL371721,CHEMBL371055,CHEMBL200403,CHEMBL200904,CHEMBL199078,CHEMBL200682,CHEMBL200498,CHEMBL372122,CHEMBL382071,CHEMBL315232,CHEMBL315251,CHEMBL329209,CHEMBL315524,CHEMBL419667,CHEMBL86384,CHEMBL86949,CHEMBL89552,CHEMBL328079,CHEMBL93603,CHEMBL314290,CHEMBL94133,CHEMBL330016,CHEMBL330094,CHEMBL328791,CHEMBL329026,CHEMBL90657,CHEMBL432043,CHEMBL327242,CHEMBL329141,CHEMBL330005,CHEMBL93366,CHEMBL327365,CHEMBL96731,CHEMBL96255,CHEMBL421180,CHEMBL329903,CHEMBL330494,CHEMBL101157,CHEMBL101935,CHEMBL100402,CHEMBL101678,CHEMBL103406,CHEMBL316958,CHEMBL396270,CHEMBL396271,CHEMBL241866,CHEMBL242082,CHEMBL387815,CHEMBL242303,CHEMBL242304,CHEMBL389581,CHEMBL389362,CHEMBL389363,CHEMBL242516,CHEMBL397187,CHEMBL242517,CHEMBL390224,CHEMBL397188,CHEMBL388253,CHEMBL397189,CHEMBL413711,CHEMBL389091,CHEMBL242534,CHEMBL244865,CHEMBL429281,CHEMBL419183,CHEMBL321656,CHEMBL109166,CHEMBL316736,CHEMBL325674,CHEMBL420500,CHEMBL115076,CHEMBL115444,CHEMBL114302,CHEMBL116463,CHEMBL119793,CHEMBL128687,CHEMBL338901,CHEMBL341339,CHEMBL341173,CHEMBL334363,CHEMBL334777,CHEMBL131439,CHEMBL337725,CHEMBL131566,CHEMBL128688,CHEMBL336825,CHEMBL344752,CHEMBL142324,CHEMBL143304,CHEMBL143341,CHEMBL358793,CHEMBL159856,CHEMBL347020,CHEMBL350089,CHEMBL351587,CHEMBL159359,CHEMBL350383,CHEMBL349506,CHEMBL392363,CHEMBL237772,CHEMBL237987,CHEMBL238206,CHEMBL235393,CHEMBL393754,CHEMBL400266,CHEMBL250346,CHEMBL400267,CHEMBL400048,CHEMBL251771,CHEMBL248733,CHEMBL249133,CHEMBL373167,CHEMBL381433,CHEMBL200922,CHEMBL200368,CHEMBL380582,CHEMBL198850,CHEMBL198475,CHEMBL200738,CHEMBL200329,CHEMBL199622,CHEMBL381448,CHEMBL200282,CHEMBL444879,CHEMBL200729,CHEMBL196816,CHEMBL382515,CHEMBL199623,CHEMBL198430,CHEMBL200415,CHEMBL196974,CHEMBL427190,CHEMBL197378,CHEMBL198622,CHEMBL383149,CHEMBL371223,CHEMBL198630,CHEMBL201889,CHEMBL203513,CHEMBL208787,CHEMBL377414,CHEMBL512257,CHEMBL467186,CHEMBL511265,CHEMBL512105,CHEMBL467378,CHEMBL467545,CHEMBL511917,CHEMBL469005,CHEMBL511215,CHEMBL466762,CHEMBL492029,CHEMBL491421,CHEMBL491422,CHEMBL521789,CHEMBL489386,CHEMBL489387,CHEMBL522255,CHEMBL515660,CHEMBL458634,CHEMBL458635,CHEMBL457544,CHEMBL459073,CHEMBL445816,CHEMBL456263,CHEMBL473872,CHEMBL509183,CHEMBL474072,CHEMBL455279,CHEMBL446566,CHEMBL474274,CHEMBL583083,CHEMBL572760,CHEMBL583084,CHEMBL572983,CHEMBL572835,CHEMBL572984,CHEMBL577599,CHEMBL575986,CHEMBL575987,CHEMBL567176,CHEMBL577816,CHEMBL575359,CHEMBL575574,CHEMBL572921,CHEMBL575796,CHEMBL575797,CHEMBL1755,CHEMBL592250,CHEMBL592493,CHEMBL592494,CHEMBL606976,CHEMBL592495,CHEMBL603205,CHEMBL592731,CHEMBL591310,CHEMBL590097,CHEMBL592732,CHEMBL609848,CHEMBL592733,CHEMBL594361,CHEMBL399288,CHEMBL249340,CHEMBL249536,CHEMBL399289,CHEMBL249741,CHEMBL438523,CHEMBL251715,CHEMBL249740,CHEMBL251561,CHEMBL400860,CHEMBL399888,CHEMBL429736,CHEMBL473106,CHEMBL482323,CHEMBL482321,CHEMBL521444,CHEMBL482322,CHEMBL480546,CHEMBL480584,CHEMBL520595,CHEMBL481568,CHEMBL481569,CHEMBL481730,CHEMBL515447,CHEMBL474609,CHEMBL515111,CHEMBL475561,CHEMBL475395,CHEMBL514031,CHEMBL447916,CHEMBL474621,CHEMBL467154,CHEMBL467184,CHEMBL467185,CHEMBL1093366,CHEMBL1093367,CHEMBL1094002,CHEMBL1092457,CHEMBL1092458,CHEMBL1092459,CHEMBL1082723,CHEMBL1084111,CHEMBL1084112,CHEMBL1084386,CHEMBL1082493,CHEMBL1086068,CHEMBL1086069,CHEMBL1086070,CHEMBL1083254,CHEMBL1084864,CHEMBL1083765,CHEMBL1084069,CHEMBL1084070,CHEMBL1082835,CHEMBL1085624,CHEMBL1085850,CHEMBL1085851,CHEMBL1085123,CHEMBL1085378,CHEMBL1084085,CHEMBL1084086,CHEMBL1084455,CHEMBL1084362,CHEMBL1084456,CHEMBL475684,CHEMBL514772,CHEMBL477868,CHEMBL449517,CHEMBL510500,CHEMBL477456,CHEMBL478902,CHEMBL478082,CHEMBL478083,CHEMBL478283,CHEMBL490049,CHEMBL490249,CHEMBL521597,CHEMBL528996,CHEMBL486064,CHEMBL486268,CHEMBL520040,CHEMBL519240,CHEMBL475306,CHEMBL506214,CHEMBL483993,CHEMBL484158,CHEMBL543854,CHEMBL539285,CHEMBL539665,CHEMBL575773,CHEMBL575972,CHEMBL57634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@attribute FCFP6_1024_0 numeric @attribute FCFP6_1024_1 numeric @attribute FCFP6_1024_2 numeric @attribute FCFP6_1024_3 numeric @attribute FCFP6_1024_4 numeric @attribute FCFP6_1024_5 numeric @attribute FCFP6_1024_6 numeric @attribute FCFP6_1024_7 numeric @attribute FCFP6_1024_8 numeric @attribute FCFP6_1024_9 numeric @attribute FCFP6_1024_10 numeric @attribute FCFP6_1024_11 numeric @attribute FCFP6_1024_12 numeric @attribute FCFP6_1024_13 numeric @attribute FCFP6_1024_14 numeric @attribute FCFP6_1024_15 numeric @attribute FCFP6_1024_16 numeric @attribute FCFP6_1024_17 numeric @attribute FCFP6_1024_18 numeric @attribute FCFP6_1024_19 numeric @attribute FCFP6_1024_20 numeric @attribute FCFP6_1024_21 numeric @attribute FCFP6_1024_22 numeric @attribute FCFP6_1024_23 numeric @attribute FCFP6_1024_24 numeric @attribute FCFP6_1024_25 numeric @attribute FCFP6_1024_26 numeric @attribute FCFP6_1024_27 numeric @attribute FCFP6_1024_28 numeric @attribute FCFP6_1024_29 numeric @attribute FCFP6_1024_30 numeric @attribute FCFP6_1024_31 numeric @attribute FCFP6_1024_32 numeric @attribute FCFP6_1024_33 numeric @attribute FCFP6_1024_34 numeric @attribute FCFP6_1024_35 numeric @attribute FCFP6_1024_36 numeric @attribute FCFP6_1024_37 numeric @attribute FCFP6_1024_38 numeric @attribute FCFP6_1024_39 numeric @attribute FCFP6_1024_40 numeric @attribute FCFP6_1024_41 numeric @attribute FCFP6_1024_42 numeric @attribute FCFP6_1024_43 numeric @attribute FCFP6_1024_44 numeric @attribute FCFP6_1024_45 numeric @attribute FCFP6_1024_46 numeric @attribute FCFP6_1024_47 numeric @attribute FCFP6_1024_48 numeric @attribute FCFP6_1024_49 numeric @attribute FCFP6_1024_50 numeric @attribute FCFP6_1024_51 numeric @attribute FCFP6_1024_52 numeric @attribute FCFP6_1024_53 numeric @attribute FCFP6_1024_54 numeric @attribute FCFP6_1024_55 numeric @attribute FCFP6_1024_56 numeric @attribute FCFP6_1024_57 numeric @attribute FCFP6_1024_58 numeric @attribute FCFP6_1024_59 numeric @attribute FCFP6_1024_60 numeric @attribute FCFP6_1024_61 numeric @attribute FCFP6_1024_62 numeric @attribute FCFP6_1024_63 numeric @attribute FCFP6_1024_64 numeric @attribute FCFP6_1024_65 numeric @attribute FCFP6_1024_66 numeric @attribute FCFP6_1024_67 numeric @attribute FCFP6_1024_68 numeric @attribute FCFP6_1024_69 numeric @attribute FCFP6_1024_70 numeric @attribute FCFP6_1024_71 numeric @attribute FCFP6_1024_72 numeric @attribute FCFP6_1024_73 numeric @attribute FCFP6_1024_74 numeric @attribute FCFP6_1024_75 numeric @attribute FCFP6_1024_76 numeric @attribute FCFP6_1024_77 numeric @attribute FCFP6_1024_78 numeric @attribute FCFP6_1024_79 numeric @attribute FCFP6_1024_80 numeric @attribute FCFP6_1024_81 numeric @attribute FCFP6_1024_82 numeric @attribute FCFP6_1024_83 numeric @attribute FCFP6_1024_84 numeric @attribute FCFP6_1024_85 numeric @attribute FCFP6_1024_86 numeric @attribute FCFP6_1024_87 numeric @attribute FCFP6_1024_88 numeric @attribute FCFP6_1024_89 numeric @attribute FCFP6_1024_90 numeric @attribute FCFP6_1024_91 numeric @attribute FCFP6_1024_92 numeric @attribute FCFP6_1024_93 numeric @attribute FCFP6_1024_94 numeric @attribute FCFP6_1024_95 numeric @attribute FCFP6_1024_96 numeric @attribute FCFP6_1024_97 numeric @attribute FCFP6_1024_98 numeric @attribute FCFP6_1024_99 numeric @attribute FCFP6_1024_100 numeric @attribute FCFP6_1024_101 numeric @attribute FCFP6_1024_102 numeric @attribute FCFP6_1024_103 numeric @attribute FCFP6_1024_104 numeric @attribute FCFP6_1024_105 numeric @attribute FCFP6_1024_106 numeric @attribute FCFP6_1024_107 numeric @attribute FCFP6_1024_108 numeric @attribute FCFP6_1024_109 numeric @attribute FCFP6_1024_110 numeric @attribute FCFP6_1024_111 numeric @attribute FCFP6_1024_112 numeric @attribute FCFP6_1024_113 numeric @attribute FCFP6_1024_114 numeric @attribute FCFP6_1024_115 numeric @attribute FCFP6_1024_116 numeric @attribute FCFP6_1024_117 numeric @attribute FCFP6_1024_118 numeric @attribute FCFP6_1024_119 numeric @attribute FCFP6_1024_120 numeric @attribute FCFP6_1024_121 numeric @attribute FCFP6_1024_122 numeric @attribute FCFP6_1024_123 numeric @attribute FCFP6_1024_124 numeric @attribute FCFP6_1024_125 numeric @attribute FCFP6_1024_126 numeric @attribute FCFP6_1024_127 numeric @attribute FCFP6_1024_128 numeric @attribute FCFP6_1024_129 numeric @attribute FCFP6_1024_130 numeric @attribute FCFP6_1024_131 numeric @attribute FCFP6_1024_132 numeric @attribute FCFP6_1024_133 numeric @attribute FCFP6_1024_134 numeric @attribute FCFP6_1024_135 numeric @attribute FCFP6_1024_136 numeric @attribute FCFP6_1024_137 numeric @attribute FCFP6_1024_138 numeric @attribute FCFP6_1024_139 numeric @attribute FCFP6_1024_140 numeric @attribute FCFP6_1024_141 numeric @attribute FCFP6_1024_142 numeric @attribute FCFP6_1024_143 numeric @attribute FCFP6_1024_144 numeric @attribute FCFP6_1024_145 numeric @attribute FCFP6_1024_146 numeric @attribute FCFP6_1024_147 numeric @attribute FCFP6_1024_148 numeric @attribute 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numeric @attribute FCFP6_1024_883 numeric @attribute FCFP6_1024_884 numeric @attribute FCFP6_1024_885 numeric @attribute FCFP6_1024_886 numeric @attribute FCFP6_1024_887 numeric @attribute FCFP6_1024_888 numeric @attribute FCFP6_1024_889 numeric @attribute FCFP6_1024_890 numeric @attribute FCFP6_1024_891 numeric @attribute FCFP6_1024_892 numeric @attribute FCFP6_1024_893 numeric @attribute FCFP6_1024_894 numeric @attribute FCFP6_1024_895 numeric @attribute FCFP6_1024_896 numeric @attribute FCFP6_1024_897 numeric @attribute FCFP6_1024_898 numeric @attribute FCFP6_1024_899 numeric @attribute FCFP6_1024_900 numeric @attribute FCFP6_1024_901 numeric @attribute FCFP6_1024_902 numeric @attribute FCFP6_1024_903 numeric @attribute FCFP6_1024_904 numeric @attribute FCFP6_1024_905 numeric @attribute FCFP6_1024_906 numeric @attribute FCFP6_1024_907 numeric @attribute FCFP6_1024_908 numeric @attribute FCFP6_1024_909 numeric @attribute FCFP6_1024_910 numeric @attribute FCFP6_1024_911 numeric @attribute FCFP6_1024_912 numeric @attribute FCFP6_1024_913 numeric @attribute FCFP6_1024_914 numeric @attribute FCFP6_1024_915 numeric @attribute FCFP6_1024_916 numeric @attribute FCFP6_1024_917 numeric @attribute FCFP6_1024_918 numeric @attribute FCFP6_1024_919 numeric @attribute FCFP6_1024_920 numeric @attribute FCFP6_1024_921 numeric @attribute FCFP6_1024_922 numeric @attribute FCFP6_1024_923 numeric @attribute FCFP6_1024_924 numeric @attribute FCFP6_1024_925 numeric @attribute FCFP6_1024_926 numeric @attribute FCFP6_1024_927 numeric @attribute FCFP6_1024_928 numeric @attribute FCFP6_1024_929 numeric @attribute FCFP6_1024_930 numeric @attribute FCFP6_1024_931 numeric @attribute FCFP6_1024_932 numeric @attribute FCFP6_1024_933 numeric @attribute FCFP6_1024_934 numeric @attribute FCFP6_1024_935 numeric @attribute FCFP6_1024_936 numeric @attribute FCFP6_1024_937 numeric @attribute FCFP6_1024_938 numeric @attribute FCFP6_1024_939 numeric @attribute FCFP6_1024_940 numeric @attribute FCFP6_1024_941 numeric @attribute FCFP6_1024_942 numeric @attribute FCFP6_1024_943 numeric @attribute FCFP6_1024_944 numeric @attribute FCFP6_1024_945 numeric @attribute FCFP6_1024_946 numeric @attribute FCFP6_1024_947 numeric @attribute FCFP6_1024_948 numeric @attribute FCFP6_1024_949 numeric @attribute FCFP6_1024_950 numeric @attribute FCFP6_1024_951 numeric @attribute FCFP6_1024_952 numeric @attribute FCFP6_1024_953 numeric @attribute FCFP6_1024_954 numeric @attribute FCFP6_1024_955 numeric @attribute FCFP6_1024_956 numeric @attribute FCFP6_1024_957 numeric @attribute FCFP6_1024_958 numeric @attribute FCFP6_1024_959 numeric @attribute FCFP6_1024_960 numeric @attribute FCFP6_1024_961 numeric @attribute FCFP6_1024_962 numeric @attribute FCFP6_1024_963 numeric @attribute FCFP6_1024_964 numeric @attribute FCFP6_1024_965 numeric @attribute FCFP6_1024_966 numeric @attribute FCFP6_1024_967 numeric @attribute FCFP6_1024_968 numeric @attribute FCFP6_1024_969 numeric @attribute FCFP6_1024_970 numeric @attribute FCFP6_1024_971 numeric @attribute FCFP6_1024_972 numeric @attribute FCFP6_1024_973 numeric @attribute FCFP6_1024_974 numeric @attribute FCFP6_1024_975 numeric @attribute FCFP6_1024_976 numeric @attribute FCFP6_1024_977 numeric @attribute FCFP6_1024_978 numeric @attribute FCFP6_1024_979 numeric @attribute FCFP6_1024_980 numeric @attribute FCFP6_1024_981 numeric @attribute FCFP6_1024_982 numeric @attribute FCFP6_1024_983 numeric @attribute FCFP6_1024_984 numeric @attribute FCFP6_1024_985 numeric @attribute FCFP6_1024_986 numeric @attribute FCFP6_1024_987 numeric @attribute FCFP6_1024_988 numeric @attribute FCFP6_1024_989 numeric @attribute FCFP6_1024_990 numeric @attribute FCFP6_1024_991 numeric @attribute FCFP6_1024_992 numeric @attribute FCFP6_1024_993 numeric @attribute FCFP6_1024_994 numeric @attribute FCFP6_1024_995 numeric @attribute FCFP6_1024_996 numeric @attribute FCFP6_1024_997 numeric @attribute FCFP6_1024_998 numeric @attribute FCFP6_1024_999 numeric @attribute FCFP6_1024_1000 numeric @attribute FCFP6_1024_1001 numeric @attribute FCFP6_1024_1002 numeric @attribute FCFP6_1024_1003 numeric @attribute FCFP6_1024_1004 numeric @attribute FCFP6_1024_1005 numeric @attribute FCFP6_1024_1006 numeric @attribute FCFP6_1024_1007 numeric @attribute FCFP6_1024_1008 numeric @attribute FCFP6_1024_1009 numeric @attribute FCFP6_1024_1010 numeric @attribute FCFP6_1024_1011 numeric @attribute FCFP6_1024_1012 numeric @attribute FCFP6_1024_1013 numeric @attribute FCFP6_1024_1014 numeric @attribute FCFP6_1024_1015 numeric @attribute FCFP6_1024_1016 numeric @attribute FCFP6_1024_1017 numeric @attribute FCFP6_1024_1018 numeric @attribute FCFP6_1024_1019 numeric @attribute FCFP6_1024_1020 numeric @attribute FCFP6_1024_1021 numeric @attribute FCFP6_1024_1022 numeric @attribute FCFP6_1024_1023 numeric @attribute MEDIAN_PXC50 numeric @data {1 1,2 1,4 1,5 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,69 1,80 1,82 1,107 1,128 1,139 1,141 1,142 1,170 1,171 1,173 1,178 1,211 1,245 1,252 1,263 1,268 1,271 1,280 1,290 1,294 1,312 1,319 1,350 1,370 1,373 1,376 1,378 1,395 1,399 1,412 1,425 1,429 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,562 1,565 1,585 1,624 1,634 1,649 1,656 1,680 1,681 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,911 1,916 1,925 1,942 1,947 1,962 1,971 1,992 1,1015 1,1025 7.495} {0 CHEMBL311230,1 1,2 1,3 1,4 1,5 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,80 1,82 1,107 1,139 1,141 1,170 1,171 1,173 1,211 1,245 1,252 1,268 1,271 1,283 1,312 1,319 1,350 1,373 1,376 1,399 1,412 1,425 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,541 1,562 1,565 1,585 1,624 1,634 1,649 1,656 1,664 1,680 1,681 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,896 1,899 1,925 1,947 1,962 1,971 1,982 1,992 1,995 1,1015 1,1025 6.194} {0 CHEMBL81755,1 1,2 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,69 1,80 1,82 1,107 1,138 1,139 1,141 1,168 1,170 1,171 1,173 1,211 1,252 1,268 1,299 1,312 1,319 1,350 1,351 1,354 1,370 1,373 1,376 1,378 1,399 1,412 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,542 1,557 1,562 1,565 1,624 1,634 1,641 1,649 1,656 1,680 1,685 1,697 1,701 1,729 1,737 1,784 1,797 1,804 1,826 1,859 1,925 1,947 1,970 1,971 1,972 1,985 1,992 1,1007 1,1015 1,1025 7.602} {0 CHEMBL80029,1 1,2 1,3 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,82 1,107 1,139 1,141 1,170 1,171 1,173 1,211 1,252 1,268 1,283 1,312 1,319 1,350 1,351 1,373 1,376 1,399 1,412 1,430 1,443 1,453 1,458 1,461 1,465 1,468 1,490 1,504 1,520 1,529 1,541 1,542 1,545 1,557 1,562 1,565 1,624 1,634 1,656 1,664 1,680 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,880 1,896 1,899 1,925 1,947 1,959 1,971 1,982 1,992 1,995 1,1012 1,1015 1,1025 6.268} {0 CHEMBL81133,1 1,2 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,80 1,82 1,107 1,139 1,141 1,168 1,170 1,171 1,173 1,211 1,252 1,268 1,282 1,283 1,299 1,312 1,319 1,350 1,351 1,354 1,355 1,373 1,376 1,399 1,406 1,412 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,540 1,542 1,557 1,562 1,565 1,624 1,634 1,649 1,656 1,664 1,668 1,680 1,685 1,701 1,729 1,737 1,784 1,797 1,804 1,826 1,859 1,898 1,925 1,947 1,970 1,971 1,972 1,1015 1,1025 6.921} {0 CHEMBL420031,1 1,2 1,3 1,4 1,5 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,80 1,82 1,107 1,139 1,141 1,170 1,171 1,173 1,211 1,245 1,252 1,268 1,271 1,283 1,312 1,319 1,350 1,373 1,376 1,399 1,412 1,425 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,541 1,562 1,565 1,585 1,624 1,634 1,649 1,656 1,664 1,680 1,681 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,896 1,899 1,925 1,947 1,962 1,971 1,982 1,992 1,995 1,1015 1,1025 7.432} {0 CHEMBL311931,1 1,2 1,3 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,82 1,107 1,118 1,127 1,141 1,161 1,170 1,171 1,173 1,211 1,252 1,268 1,283 1,294 1,312 1,319 1,350 1,351 1,373 1,376 1,399 1,412 1,422 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,541 1,542 1,557 1,562 1,565 1,624 1,634 1,656 1,664 1,680 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,896 1,899 1,925 1,947 1,948 1,970 1,971 1,982 1,992 1,995 1,1012 1,1015 1,1025 6.367} {0 CHEMBL420762,1 1,2 1,4 1,10 1,17 1,25 1,53 1,54 1,65 1,69 1,107 1,170 1,171 1,182 1,191 1,222 1,282 1,283 1,286 1,351 1,370 1,376 1,382 1,412 1,420 1,422 1,430 1,432 1,453 1,458 1,461 1,490 1,529 1,542 1,557 1,562 1,566 1,574 1,577 1,644 1,664 1,669 1,674 1,680 1,724 1,739 1,741 1,797 1,804 1,829 1,872 1,925 1,940 1,947 1,956 1,967 1,970 1,1012 1,1025 6.71} {0 CHEMBL314344,1 1,2 1,3 1,4 1,5 1,12 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,82 1,107 1,118 1,141 1,160 1,170 1,171 1,173 1,183 1,211 1,252 1,268 1,271 1,283 1,312 1,319 1,350 1,373 1,376 1,399 1,412 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,541 1,562 1,565 1,624 1,634 1,647 1,656 1,664 1,680 1,685 1,701 1,776 1,784 1,797 1,804 1,815 1,826 1,827 1,859 1,882 1,896 1,899 1,925 1,947 1,971 1,982 1,992 1,995 1,1015 1,1025 5.357} {0 CHEMBL420216,1 1,2 1,3 1,4 1,17 1,18 1,25 1,28 1,29 1,33 1,54 1,57 1,65 1,82 1,107 1,141 1,170 1,171 1,173 1,211 1,252 1,268 1,283 1,299 1,312 1,319 1,350 1,351 1,373 1,375 1,376 1,399 1,412 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,514 1,529 1,541 1,542 1,557 1,562 1,565 1,624 1,627 1,634 1,656 1,664 1,680 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,896 1,899 1,901 1,925 1,947 1,970 1,971 1,982 1,992 1,995 1,1009 1,1015 1,1019 1,1025 6.469} {0 CHEMBL310416,1 1,2 1,3 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,82 1,107 1,141 1,170 1,171 1,173 1,211 1,252 1,268 1,283 1,312 1,319 1,350 1,351 1,373 1,376 1,399 1,412 1,422 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,541 1,542 1,557 1,562 1,565 1,566 1,624 1,634 1,656 1,664 1,680 1,685 1,701 1,784 1,797 1,804 1,826 1,859 1,896 1,899 1,925 1,947 1,970 1,971 1,982 1,992 1,995 1,1012 1,1015 1,1025 7.229} {0 CHEMBL312036,1 1,2 1,4 1,17 1,18 1,25 1,29 1,33 1,54 1,57 1,65 1,80 1,82 1,92 1,107 1,128 1,139 1,141 1,168 1,170 1,171 1,173 1,185 1,211 1,252 1,268 1,283 1,299 1,305 1,312 1,319 1,350 1,351 1,354 1,373 1,376 1,399 1,412 1,422 1,429 1,430 1,443 1,453 1,458 1,461 1,490 1,504 1,529 1,542 1,557 1,562 1,565 1,569 1,614 1,624 1,634 1,649 1,656 1,664 1,680 1,681 1,685 1,701 1,729 1,737 1,784 1,797 1,804 1,826 1,859 1,867 1,872 1,925 1,942 1,947 1,970 1,971 1,972 1,1015 1,1025 7.824} {0 CHEMBL314908,1 1,2 1,8 1,10 1,17 1,18 1,24 1,37 1,38 1,52 1,65 1,69 1,117 1,137 1,170 1,182 1,235 1,256 1,298 1,320 1,325 1,344 1,351 1,362 1,363 1,376 1,377 1,387 1,406 1,429 1,444 1,454 1,461 1,468 1,485 1,543 1,553 1,574 1,602 1,608 1,628 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,835 1,841 1,847 1,872 1,879 1,904 1,916 1,927 1,937 1,945 1,947 1,961 1,978 1,985 1,993 1,1005 1,1025 7.405} {0 CHEMBL86667,1 1,2 1,8 1,10 1,17 1,18 1,20 1,25 1,37 1,38 1,65 1,69 1,137 1,170 1,171 1,172 1,173 1,235 1,241 1,246 1,265 1,279 1,290 1,292 1,298 1,320 1,325 1,344 1,351 1,362 1,370 1,376 1,380 1,387 1,389 1,416 1,429 1,451 1,454 1,461 1,490 1,509 1,510 1,523 1,535 1,553 1,557 1,574 1,608 1,626 1,630 1,642 1,644 1,650 1,669 1,692 1,695 1,698 1,731 1,738 1,772 1,781 1,787 1,790 1,800 1,804 1,841 1,879 1,899 1,904 1,908 1,921 1,925 1,927 1,961 1,978 1,980 1,993 1,994 1,1018 1,1025 8.996} {0 CHEMBL316093,1 1,2 1,8 1,10 1,17 1,18 1,25 1,37 1,38 1,65 1,69 1,137 1,170 1,171 1,172 1,173 1,182 1,197 1,235 1,241 1,246 1,279 1,290 1,292 1,298 1,320 1,351 1,360 1,362 1,376 1,387 1,389 1,416 1,429 1,454 1,460 1,461 1,490 1,509 1,510 1,523 1,553 1,571 1,602 1,608 1,642 1,644 1,650 1,669 1,692 1,698 1,706 1,731 1,738 1,772 1,781 1,787 1,790 1,800 1,804 1,841 1,879 1,904 1,908 1,921 1,925 1,927 1,961 1,978 1,993 1,994 1,1002 1,1018 1,1025 8.092} {0 CHEMBL86936,1 1,2 1,8 1,10 1,17 1,18 1,24 1,37 1,38 1,65 1,69 1,137 1,152 1,170 1,182 1,235 1,298 1,320 1,351 1,360 1,362 1,363 1,376 1,387 1,406 1,429 1,454 1,460 1,461 1,468 1,485 1,503 1,553 1,571 1,574 1,602 1,608 1,612 1,615 1,628 1,638 1,644 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,841 1,847 1,872 1,879 1,903 1,904 1,908 1,916 1,925 1,927 1,945 1,947 1,961 1,978 1,985 1,986 1,993 1,1002 1,1005 1,1013 1,1018 1,1025 8.038} {0 CHEMBL89177,1 1,2 1,8 1,10 1,17 1,18 1,24 1,38 1,65 1,69 1,71 1,98 1,120 1,133 1,137 1,170 1,235 1,294 1,298 1,301 1,320 1,351 1,362 1,363 1,367 1,376 1,387 1,406 1,429 1,454 1,461 1,468 1,485 1,487 1,504 1,521 1,529 1,553 1,574 1,608 1,628 1,669 1,692 1,698 1,731 1,738 1,759 1,762 1,781 1,787 1,790 1,817 1,838 1,841 1,847 1,872 1,876 1,879 1,897 1,904 1,916 1,927 1,945 1,947 1,961 1,971 1,978 1,985 1,993 1,1005 1,1021 1,1025 8.043} {0 CHEMBL89015,1 1,2 1,8 1,10 1,17 1,18 1,37 1,38 1,52 1,65 1,69 1,137 1,170 1,179 1,182 1,219 1,235 1,256 1,271 1,298 1,320 1,325 1,326 1,344 1,351 1,362 1,376 1,377 1,387 1,396 1,406 1,429 1,440 1,444 1,454 1,461 1,468 1,485 1,496 1,543 1,553 1,574 1,602 1,608 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,781 1,787 1,835 1,841 1,859 1,872 1,879 1,904 1,916 1,927 1,937 1,961 1,985 1,993 1,1005 1,1025 5} {0 CHEMBL330510,1 1,2 1,8 1,10 1,17 1,18 1,37 1,38 1,52 1,65 1,69 1,129 1,137 1,170 1,179 1,182 1,219 1,235 1,256 1,271 1,298 1,317 1,318 1,320 1,325 1,326 1,344 1,351 1,362 1,376 1,377 1,387 1,406 1,429 1,444 1,454 1,461 1,464 1,468 1,485 1,543 1,553 1,574 1,584 1,602 1,608 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,781 1,787 1,801 1,835 1,841 1,872 1,879 1,904 1,916 1,925 1,927 1,937 1,961 1,985 1,993 1,1005 1,1025 6.67} {0 CHEMBL313451,1 1,2 1,8 1,10 1,17 1,18 1,24 1,37 1,38 1,52 1,65 1,69 1,117 1,137 1,170 1,182 1,235 1,256 1,298 1,320 1,325 1,344 1,351 1,362 1,363 1,376 1,377 1,387 1,406 1,429 1,444 1,454 1,461 1,468 1,485 1,543 1,553 1,574 1,602 1,608 1,628 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,835 1,841 1,847 1,872 1,879 1,904 1,916 1,927 1,937 1,945 1,947 1,961 1,978 1,985 1,993 1,1005 1,1025 7.879} {0 CHEMBL86577,1 1,2 1,8 1,10 1,17 1,18 1,24 1,25 1,37 1,38 1,65 1,69 1,137 1,170 1,171 1,172 1,173 1,182 1,197 1,235 1,241 1,246 1,279 1,292 1,298 1,320 1,351 1,360 1,362 1,363 1,376 1,387 1,389 1,429 1,454 1,460 1,461 1,468 1,471 1,490 1,509 1,553 1,571 1,602 1,608 1,628 1,642 1,644 1,650 1,669 1,692 1,698 1,706 1,731 1,738 1,759 1,781 1,787 1,790 1,800 1,804 1,841 1,847 1,879 1,904 1,908 1,925 1,927 1,947 1,961 1,978 1,993 1,994 1,1002 1,1025 8.519} {0 CHEMBL87455,1 1,2 1,8 1,10 1,17 1,18 1,24 1,37 1,38 1,52 1,65 1,69 1,137 1,170 1,235 1,256 1,298 1,320 1,325 1,344 1,351 1,362 1,363 1,376 1,387 1,406 1,429 1,444 1,454 1,461 1,468 1,485 1,553 1,574 1,603 1,608 1,628 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,841 1,847 1,872 1,879 1,899 1,904 1,916 1,927 1,945 1,947 1,961 1,978 1,985 1,993 1,1005 1,1025 7.857} {0 CHEMBL87887,1 1,2 1,8 1,10 1,17 1,18 1,24 1,37 1,38 1,52 1,65 1,69 1,117 1,137 1,170 1,182 1,235 1,256 1,298 1,320 1,325 1,344 1,351 1,362 1,363 1,376 1,377 1,387 1,406 1,429 1,444 1,454 1,461 1,468 1,485 1,543 1,553 1,574 1,602 1,608 1,628 1,630 1,644 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,835 1,841 1,847 1,872 1,879 1,904 1,916 1,927 1,937 1,945 1,947 1,961 1,978 1,985 1,993 1,1005 1,1025 8.347} {0 CHEMBL87351,1 1,2 1,8 1,10 1,17 1,18 1,24 1,38 1,65 1,69 1,128 1,137 1,170 1,235 1,298 1,320 1,351 1,362 1,363 1,376 1,387 1,429 1,454 1,461 1,468 1,553 1,608 1,628 1,637 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,841 1,847 1,879 1,904 1,927 1,942 1,947 1,961 1,978 1,993 1,1025 6.921} {0 CHEMBL432375,1 1,2 1,4 1,8 1,10 1,17 1,18 1,24 1,38 1,56 1,65 1,69 1,122 1,137 1,164 1,166 1,170 1,235 1,271 1,298 1,320 1,351 1,362 1,363 1,364 1,376 1,387 1,406 1,408 1,429 1,454 1,461 1,468 1,553 1,574 1,603 1,608 1,628 1,638 1,669 1,692 1,698 1,731 1,738 1,759 1,781 1,787 1,790 1,817 1,841 1,843 1,847 1,859 1,872 1,878 1,879 1,904 1,916 1,927 1,945 1,947 1,961 1,978 1,981 1,985 1,993 1,1005 1,1025 8.674} {0 CHEMBL411,1 1,8 1,17 1,25 1,44 1,56 1,77 1,170 1,187 1,276 1,566 1,574 1,623 1,648 1,672 1,698 1,804 1,847 1,884 1,888 1,938 1,1025 4.785} {0 CHEMBL380579,1 1,2 1,6 1,9 1,17 1,18 1,25 1,29 1,53 1,65 1,69 1,82 1,141 1,170 1,171 1,173 1,178 1,199 1,211 1,252 1,268 1,289 1,312 1,326 1,350 1,365 1,373 1,376 1,378 1,387 1,388 1,399 1,412 1,430 1,443 1,460 1,461 1,490 1,504 1,533 1,553 1,562 1,565 1,585 1,624 1,625 1,634 1,656 1,661 1,685 1,692 1,701 1,784 1,787 1,797 1,804 1,826 1,837 1,859 1,870 1,873 1,925 1,947 1,971 1,994 1,1015 1,1025 7.194} {0 CHEMBL245086,1 1,2 1,17 1,25 1,28 1,61 1,108 1,120 1,137 1,153 1,170 1,171 1,173 1,174 1,185 1,208 1,235 1,236 1,238 1,239 1,354 1,373 1,383 1,395 1,407 1,414 1,415 1,444 1,461 1,484 1,485 1,497 1,511 1,512 1,514 1,524 1,557 1,589 1,608 1,669 1,685 1,702 1,712 1,719 1,737 1,749 1,782 1,800 1,804 1,817 1,834 1,872 1,902 1,908 1,925 1,944 1,960 1,964 1,971 1,985 1,986 1,991 1,1025 7} {0 CHEMBL576147,1 1,2 1,4 1,17 1,18 1,25 1,33 1,57 1,65 1,78 1,80 1,128 1,137 1,139 1,167 1,170 1,171 1,176 1,183 1,222 1,302 1,319 1,349 1,357 1,358 1,363 1,375 1,376 1,399 1,412 1,427 1,430 1,447 1,461 1,493 1,494 1,521 1,524 1,545 1,552 1,555 1,562 1,574 1,594 1,603 1,629 1,649 1,669 1,680 1,685 1,694 1,695 1,697 1,710 1,714 1,748 1,783 1,804 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6.721} {0 CHEMBL399289,1 1,2 1,4 1,5 1,8 1,17 1,25 1,33 1,54 1,57 1,65 1,69 1,78 1,86 1,107 1,110 1,128 1,139 1,142 1,170 1,171 1,178 1,222 1,263 1,271 1,280 1,290 1,294 1,305 1,319 1,354 1,360 1,370 1,376 1,395 1,406 1,412 1,413 1,427 1,429 1,430 1,438 1,447 1,453 1,458 1,461 1,490 1,529 1,540 1,556 1,557 1,562 1,574 1,583 1,592 1,649 1,665 1,668 1,669 1,674 1,680 1,696 1,719 1,724 1,729 1,757 1,790 1,797 1,804 1,839 1,852 1,855 1,863 1,911 1,916 1,925 1,942 1,947 1,956 1,991 1,992 1,993 1,1025 7.386} {0 CHEMBL249741,1 1,2 1,4 1,5 1,8 1,17 1,25 1,33 1,54 1,57 1,65 1,69 1,78 1,86 1,107 1,110 1,128 1,139 1,142 1,170 1,171 1,178 1,222 1,263 1,271 1,280 1,290 1,294 1,305 1,319 1,354 1,360 1,370 1,376 1,395 1,406 1,412 1,413 1,427 1,429 1,430 1,438 1,447 1,453 1,458 1,461 1,490 1,529 1,540 1,556 1,557 1,562 1,574 1,583 1,592 1,649 1,665 1,668 1,669 1,674 1,680 1,696 1,719 1,724 1,729 1,757 1,790 1,797 1,804 1,839 1,852 1,855 1,863 1,911 1,916 1,925 1,942 1,947 1,956 1,991 1,992 1,993 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1,2 1,4 1,17 1,18 1,25 1,33 1,39 1,40 1,57 1,78 1,80 1,122 1,137 1,139 1,152 1,170 1,178 1,200 1,208 1,215 1,319 1,365 1,376 1,393 1,439 1,446 1,455 1,489 1,492 1,523 1,560 1,563 1,574 1,603 1,614 1,647 1,649 1,714 1,736 1,799 1,804 1,859 1,895 1,896 1,922 1,925 1,940 1,943 1,954 1,1025 7.55} {0 CHEMBL1807276,1 1,2 1,4 1,17 1,18 1,25 1,33 1,39 1,40 1,57 1,78 1,80 1,113 1,122 1,137 1,139 1,152 1,170 1,178 1,200 1,208 1,215 1,319 1,365 1,376 1,393 1,439 1,446 1,455 1,489 1,492 1,523 1,560 1,563 1,574 1,603 1,614 1,647 1,649 1,714 1,736 1,799 1,804 1,859 1,895 1,896 1,915 1,922 1,925 1,940 1,943 1,954 1,1025 8.15} {0 CHEMBL1807277,1 1,2 1,4 1,17 1,25 1,33 1,50 1,57 1,78 1,80 1,122 1,137 1,139 1,152 1,170 1,208 1,215 1,319 1,358 1,365 1,376 1,393 1,455 1,489 1,491 1,492 1,499 1,511 1,560 1,574 1,588 1,591 1,603 1,614 1,649 1,714 1,736 1,799 1,804 1,847 1,859 1,860 1,925 1,943 1,948 1,1025 8.621} {0 CHEMBL1807278,1 1,2 1,4 1,17 1,25 1,33 1,50 1,57 1,78 1,80 1,137 1,139 1,152 1,170 1,178 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1,714 1,728 1,736 1,799 1,804 1,851 1,860 1,925 1,943 1,948 1,1025 8.03} {0 CHEMBL2113194,1 1,2 1,4 1,17 1,25 1,27 1,32 1,33 1,53 1,54 1,65 1,87 1,107 1,152 1,167 1,169 1,170 1,171 1,183 1,194 1,200 1,220 1,240 1,269 1,271 1,281 1,286 1,339 1,349 1,351 1,365 1,369 1,376 1,395 1,396 1,399 1,412 1,429 1,440 1,453 1,460 1,461 1,499 1,524 1,577 1,622 1,626 1,627 1,629 1,639 1,657 1,669 1,698 1,792 1,804 1,811 1,821 1,847 1,920 1,925 1,931 1,946 1,974 1,985 1,1025 5} {0 CHEMBL2113195,1 1,2 1,4 1,10 1,17 1,25 1,27 1,32 1,33 1,37 1,54 1,57 1,61 1,65 1,87 1,107 1,113 1,118 1,137 1,139 1,145 1,152 1,167 1,169 1,170 1,179 1,180 1,182 1,200 1,240 1,248 1,271 1,274 1,277 1,281 1,285 1,286 1,319 1,339 1,349 1,365 1,376 1,395 1,397 1,399 1,402 1,406 1,412 1,429 1,440 1,446 1,460 1,461 1,464 1,472 1,490 1,499 1,508 1,517 1,532 1,563 1,574 1,585 1,604 1,629 1,630 1,639 1,644 1,649 1,662 1,669 1,698 1,804 1,821 1,841 1,875 1,893 1,923 1,925 1,932 1,942 1,974 1,985 1,1025 5.891} {0 CHEMBL2113196,1 1,2 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