@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL4093 @attribute molecule_id {CHEMBL1089231,CHEMBL1089232,CHEMBL1089233,CHEMBL1089900,CHEMBL1089901,CHEMBL1090238,CHEMBL1090569,CHEMBL1090570,CHEMBL1090916,CHEMBL1091034,CHEMBL1091958,CHEMBL1091976,CHEMBL1092952,CHEMBL1093258,CHEMBL1093259,CHEMBL1093260,CHEMBL1093266,CHEMBL1093499,CHEMBL1093523,CHEMBL1093532,CHEMBL1093554,CHEMBL1093828,CHEMBL1093840,CHEMBL1093915,CHEMBL1093916,CHEMBL1094741,CHEMBL1094742,CHEMBL1095714,CHEMBL1095715,CHEMBL1096719,CHEMBL1097140,CHEMBL1097158,CHEMBL1097159,CHEMBL1097160,CHEMBL1097799,CHEMBL1098401,CHEMBL1098402,CHEMBL1098403,CHEMBL1098831,CHEMBL1098832,CHEMBL1098850,CHEMBL1099133,CHEMBL1209109,CHEMBL1209170,CHEMBL1209173,CHEMBL158781,CHEMBL1671971,CHEMBL1709579,CHEMBL1712120,CHEMBL1718444,CHEMBL1727326,CHEMBL1735739,CHEMBL189228,CHEMBL189532,CHEMBL189938,CHEMBL190901,CHEMBL191263,CHEMBL191419,CHEMBL191965,CHEMBL192837,CHEMBL194192,CHEMBL194353,CHEMBL194409,CHEMBL194573,CHEMBL194642,CHEMBL194679,CHEMBL194733,CHEMBL194866,CHEMBL195184,CHEMBL196106,CHEMBL196145,CHEMBL196335,CHEMBL196340,CHEMBL197265,CHEMBL197522,CHEMBL199255,CHEMBL2012762,CHEMBL2012763,CHEMBL2012764,CHEMBL2012765,CHEMBL2012766,CHEMBL2012767,CHEMBL2012768,CHEMBL203454,CHEMBL203682,CHEMBL203824,CHEMBL2069318,CHEMBL2069319,CHEMBL207019,CHEMBL2070345,CHEMBL2070346,CHEMBL2070347,CHEMBL2070348,CHEMBL2070349,CHEMBL2070350,CHEMBL2070351,CHEMBL2070352,CHEMBL2070353,CHEMBL2070354,CHEMBL2070355,CHEMBL2070356,CHEMBL2070357,CHEMBL2070358,CHEMBL2070359,CHEMBL2070360,CHEMBL2070361,CHEMBL2070362,CHEMBL2070363,CHEMBL2070364,CHEMBL2070365,CHEMBL2070366,CHEMBL2070367,CHEMBL2070368,CHEMBL2070369,CHEMBL2070370,CHEMBL2070371,CHEMBL2070372,CHEMBL2070448,CHEMBL2070449,CHEMBL2070450,CHEMBL2070451,CHEMBL2070452,CHEMBL2070453,CHEMBL2070454,CHEMBL2070455,CHEMBL2070456,CHEMBL2070457,CHEMBL2070458,CHEMBL2070459,CHEMBL2070460,CHEMBL2070461,CHEMBL2070462,CHEMBL2070463,CHEMBL2070464,CHEMBL2070465,CHEMBL2070466,CHEMBL207103,CHEMBL207142,CHEMBL207188,CHEMBL207236,CHEMBL207382,CHEMBL207442,CHEMBL207690,CHEMBL207907,CHEMBL208567,CHEMBL208711,CHEMBL208967,CHEMBL209563,CHEMBL210454,CHEMBL210613,CHEMBL210768,CHEMBL210917,CHEMBL210973,CHEMBL210990,CHEMBL214074,CHEMBL214275,CHEMBL214324,CHEMBL214465,CHEMBL214546,CHEMBL214687,CHEMBL214719,CHEMBL214727,CHEMBL214741,CHEMBL214777,CHEMBL214832,CHEMBL214867,CHEMBL214915,CHEMBL214942,CHEMBL214948,CHEMBL215036,CHEMBL215042,CHEMBL215108,CHEMBL215129,CHEMBL215130,CHEMBL215154,CHEMBL215167,CHEMBL215327,CHEMBL215445,CHEMBL215585,CHEMBL215598,CHEMBL215647,CHEMBL215663,CHEMBL215775,CHEMBL215789,CHEMBL215904,CHEMBL215959,CHEMBL216055,CHEMBL216645,CHEMBL2169907,CHEMBL217118,CHEMBL2171827,CHEMBL2171828,CHEMBL2171829,CHEMBL2171901,CHEMBL2171902,CHEMBL2171903,CHEMBL2171904,CHEMBL2171905,CHEMBL2171907,CHEMBL2171908,CHEMBL2171909,CHEMBL2171910,CHEMBL2171911,CHEMBL2171912,CHEMBL2171913,CHEMBL2171914,CHEMBL2171915,CHEMBL2171916,CHEMBL2171917,CHEMBL217376,CHEMBL217704,CHEMBL2204435,CHEMBL225828,CHEMBL225878,CHEMBL225879,CHEMBL225884,CHEMBL225935,CHEMBL225936,CHEMBL225937,CHEMBL225994,CHEMBL225995,CHEMBL225996,CHEMBL226047,CHEMBL226049,CHEMBL226096,CHEMBL226097,CHEMBL226098,CHEMBL226138,CHEMBL226408,CHEMBL226461,CHEMBL226462,CHEMBL231782,CHEMBL2326845,CHEMBL23296,CHEMBL233369,CHEMBL233426,CHEMBL233428,CHEMBL233569,CHEMBL233571,CHEMBL234387,CHEMBL234388,CHEMBL234591,CHEMBL234592,CHEMBL234593,CHEMBL234594,CHEMBL234595,CHEMBL234802,CHEMBL234806,CHEMBL242291,CHEMBL242293,CHEMBL242526,CHEMBL242527,CHEMBL242528,CHEMBL242620,CHEMBL242622,CHEMBL242840,CHEMBL242841,CHEMBL242842,CHEMBL243063,CHEMBL243275,CHEMBL243276,CHEMBL243493,CHEMBL243494,CHEMBL243531,CHEMBL243718,CHEMBL243719,CHEMBL243927,CHEMBL245943,CHEMBL246144,CHEMBL248711,CHEMBL248900,CHEMBL248901,CHEMBL249105,CHEMBL249106,CHEMBL249313,CHEMBL249314,CHEMBL249315,CHEMBL249512,CHEMBL249513,CHEMBL249717,CHEMBL249718,CHEMBL249924,CHEMBL249925,CHEMBL249926,CHEMBL250128,CHEMBL250129,CHEMBL250241,CHEMBL250332,CHEMBL250333,CHEMBL250537,CHEMBL250538,CHEMBL250741,CHEMBL250742,CHEMBL250939,CHEMBL250940,CHEMBL251130,CHEMBL251140,CHEMBL251141,CHEMBL251331,CHEMBL251332,CHEMBL251530,CHEMBL251531,CHEMBL251532,CHEMBL251538,CHEMBL251539,CHEMBL251736,CHEMBL253311,CHEMBL253312,CHEMBL253398,CHEMBL253521,CHEMBL253730,CHEMBL253731,CHEMBL254333,CHEMBL254335,CHEMBL254539,CHEMBL254541,CHEMBL254542,CHEMBL254945,CHEMBL258490,CHEMBL258491,CHEMBL258527,CHEMBL258528,CHEMBL258706,CHEMBL260632,CHEMBL263089,CHEMBL269277,CHEMBL269442,CHEMBL307429,CHEMBL329471,CHEMBL364012,CHEMBL364666,CHEMBL365544,CHEMBL365750,CHEMBL370175,CHEMBL370285,CHEMBL371990,CHEMBL372612,CHEMBL374804,CHEMBL376568,CHEMBL376595,CHEMBL377218,CHEMBL378074,CHEMBL379225,CHEMBL381064,CHEMBL382789,CHEMBL382942,CHEMBL383646,CHEMBL383657,CHEMBL383728,CHEMBL383944,CHEMBL383945,CHEMBL383959,CHEMBL384246,CHEMBL384298,CHEMBL385052,CHEMBL385411,CHEMBL385489,CHEMBL385544,CHEMBL385546,CHEMBL386174,CHEMBL386260,CHEMBL386530,CHEMBL386603,CHEMBL386772,CHEMBL387484,CHEMBL387653,CHEMBL387997,CHEMBL388024,CHEMBL389563,CHEMBL389564,CHEMBL389859,CHEMBL389979,CHEMBL391417,CHEMBL391853,CHEMBL391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@attribute P_VSA_i_4 numeric @attribute SpMAD_EA.dm. numeric @attribute X2A numeric @attribute SpMaxA_EA.dm. numeric @attribute GATS4i numeric @attribute ATSC8s numeric @attribute nF numeric @attribute NsF numeric @attribute P_VSA_e_6 numeric @attribute SpMax1_Bh.s. numeric @attribute SsF numeric @attribute ATSC2s numeric @attribute ATSC8e numeric @attribute ZM2Per numeric @attribute C.022 numeric @attribute nCsp numeric @attribute nR.C. numeric @attribute NtsC numeric @attribute StsC numeric @attribute nHet numeric @attribute ATSC3s numeric @attribute ZM2Kup numeric @attribute P_VSA_MR_5 numeric @attribute ATSC6s numeric @attribute MATS1i numeric @attribute GATS6v numeric @attribute P_VSA_s_5 numeric @attribute Eig01_EA.dm. numeric @attribute SpMax_EA.dm. numeric @attribute CATS2D_08_DA numeric @attribute IC1 numeric @attribute ATS2s numeric @attribute AAC numeric @attribute IC0 numeric @attribute GMTIV numeric @attribute nTB numeric @attribute SM08_EA.dm. numeric @attribute SM10_EA.dm. numeric @attribute SM12_EA.dm. numeric @attribute SM14_EA.dm. numeric @attribute SpMax1_Bh.v. numeric @attribute GGI6 numeric @attribute SpMin2_Bh.p. numeric @attribute IAC numeric @attribute TIC0 numeric @attribute S3K numeric @attribute Eig04_AEA.dm. numeric @attribute SM06_EA.dm. numeric @attribute Eig03_EA numeric @attribute SM11_AEA.bo. numeric @attribute SpMax1_Bh.i. numeric @attribute ATSC6i numeric @attribute Psi_i_s numeric @attribute Eig01_EA.ed. numeric @attribute SM10_AEA.dm. numeric @attribute SpMax_EA.ed. numeric @attribute ZM2V numeric @attribute ZM2MulPer numeric @attribute SM04_EA.dm. numeric @attribute Eig01_EA numeric @attribute SM09_AEA.bo. numeric @attribute SpDiam_EA numeric @attribute SpMax_EA numeric @attribute MAXDN numeric @attribute ATSC1s numeric @attribute MATS4i numeric @attribute pXC50 numeric @data {1 96.462,2 0.287,3 0.284,4 0.113,5 0.928,6 43.061,7 3,8 3,9 44.88,10 8.513,11 39.861,12 136.379,13 0.333,14 797.61,20 7,21 46.41,22 536.679,23 44.397,24 72.022,25 -0.034,26 1.165,27 18.011,28 3.825,29 3.825,31 3.403,32 6.174,33 1.643,34 1.643,35 44660,37 10.734,38 13.416,39 16.1,40 18.783,41 4.037,42 0.806,43 2.043,44 80.513,45 80.513,46 4.056,47 2.862,48 8.059,49 2.928,50 2.928,51 4.138,52 1.625,53 83.417,54 12.454,55 12.454,56 12.454,57 498,58 529.598,59 5.431,60 3.415,61 3.415,62 5.415,63 3.415,64 5.743,65 21.646,66 0.03,67 6} {0 CHEMBL1089232,1 78.451,2 0.387,3 0.289,4 0.109,5 0.936,6 135.834,7 3,8 3,9 44.88,10 8.513,11 40.138,12 169.514,13 0.811,14 870.81,20 8,21 86.456,22 559.358,23 28.921,24 93.46,25 -0.023,26 1.226,28 3.825,29 3.825,31 3.405,32 6.3,33 1.761,34 1.761,35 50092,37 10.957,38 13.555,39 16.184,40 18.834,41 4.06,42 1.011,43 2.055,44 89.789,45 89.789,46 4.405,47 2.896,48 8.407,49 3.063,50 3.063,51 4.148,52 1.746,53 88.667,54 12.458,55 12.458,56 12.458,57 546,58 583.403,59 5.933,60 3.416,61 3.416,62 5.416,63 3.416,64 5.761,65 34.87,66 0.027,67 5.57} {0 CHEMBL1089233,1 78.451,2 0.411,3 0.291,4 0.116,5 0.943,6 72.719,7 3,8 3,9 44.88,10 8.513,11 39.431,12 169.168,13 0.461,14 839.35,20 8,21 95.717,22 540.006,23 23.852,24 112.869,25 -0.025,26 1.068,28 3.825,29 3.825,31 3.24,32 6.264,33 1.815,34 1.815,35 47142,37 10.957,38 13.555,39 16.184,40 18.834,41 4.053,42 0.767,43 2.055,44 81.668,45 81.668,46 4.086,47 2.892,48 8.407,49 2.952,50 2.952,51 4.138,52 1.308,53 85.5,54 12.433,55 12.433,56 12.433,57 527,58 564.413,59 5.933,60 3.407,61 3.407,62 5.407,63 3.407,64 5.752,65 40.039,66 -0.015,67 6} {0 CHEMBL1089900,1 78.451,2 0.399,3 0.29,4 0.113,5 0.945,6 60.492,7 3,8 3,9 44.88,10 8.513,11 39.803,12 169.971,13 0.406,14 860.67,20 8,21 88.408,22 553.358,23 26.386,24 86.979,25 -0.024,26 1.084,28 3.825,29 3.825,31 3.353,32 6.284,33 1.787,34 1.787,35 50213,37 10.957,38 13.555,39 16.184,40 18.834,41 4.056,42 0.909,43 2.054,44 85.795,45 85.795,46 4.172,47 2.88,48 8.407,49 3.048,50 3.048,51 4.144,52 1.493,53 87.167,54 12.454,55 12.454,56 12.454,57 540,58 578.021,59 5.933,60 3.415,61 3.415,62 5.415,63 3.415,64 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