@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL2662

@attribute molecule_id {CHEMBL1215659,CHEMBL2047851,CHEMBL2047852,CHEMBL2047853,CHEMBL2047854,CHEMBL2047855,CHEMBL2047856,CHEMBL2047857,CHEMBL2047858,CHEMBL2047859,CHEMBL2047860,CHEMBL2047861,CHEMBL2047862,CHEMBL2049092,CHEMBL2049093,CHEMBL2049094,CHEMBL2049095,CHEMBL2049096,CHEMBL2049097,CHEMBL2049098,CHEMBL2049099,CHEMBL2049100}
@attribute AAC numeric
@attribute AECC numeric
@attribute ALOGP numeric
@attribute ALOGP2 numeric
@attribute AMR numeric
@attribute AMW numeric
@attribute ARR numeric
@attribute ATS1e numeric
@attribute ATS1i numeric
@attribute ATS1m numeric
@attribute ATS1p numeric
@attribute ATS1s numeric
@attribute ATS1v numeric
@attribute ATS2e numeric
@attribute ATS2i numeric
@attribute ATS2m numeric
@attribute ATS2p numeric
@attribute ATS2s numeric
@attribute ATS2v numeric
@attribute ATS3e numeric
@attribute ATS3i numeric
@attribute ATS3m numeric
@attribute ATS3p numeric
@attribute ATS3s numeric
@attribute ATS3v numeric
@attribute ATS4e numeric
@attribute ATS4i numeric
@attribute ATS4m numeric
@attribute ATS4p numeric
@attribute ATS4s numeric
@attribute ATS4v numeric
@attribute ATS5e numeric
@attribute ATS5i numeric
@attribute ATS5m numeric
@attribute ATS5p numeric
@attribute ATS5s numeric
@attribute ATS5v numeric
@attribute ATS6e numeric
@attribute ATS6i numeric
@attribute ATS6m numeric
@attribute ATS6p numeric
@attribute ATS6s numeric
@attribute ATS6v numeric
@attribute ATS7e numeric
@attribute ATS7i numeric
@attribute ATS7m numeric
@attribute ATS7p numeric
@attribute ATS7s numeric
@attribute ATS7v numeric
@attribute ATS8e numeric
@attribute ATS8i numeric
@attribute ATS8m numeric
@attribute ATS8p numeric
@attribute ATS8s numeric
@attribute ATS8v numeric
@attribute ATSC1e numeric
@attribute ATSC1i numeric
@attribute ATSC1m numeric
@attribute ATSC1p numeric
@attribute ATSC1s numeric
@attribute ATSC1v numeric
@attribute ATSC2e numeric
@attribute ATSC2i numeric
@attribute ATSC2m numeric
@attribute ATSC2p numeric
@attribute ATSC2s numeric
@attribute ATSC2v numeric
@attribute ATSC3e numeric
@attribute ATSC3i numeric
@attribute ATSC3m numeric
@attribute ATSC3p numeric
@attribute ATSC3s numeric
@attribute ATSC3v numeric
@attribute ATSC4e numeric
@attribute ATSC4i numeric
@attribute ATSC4m numeric
@attribute ATSC4p numeric
@attribute ATSC4s numeric
@attribute ATSC4v numeric
@attribute ATSC5e numeric
@attribute ATSC5i numeric
@attribute ATSC5m numeric
@attribute ATSC5p numeric
@attribute ATSC5s numeric
@attribute ATSC5v numeric
@attribute ATSC6e numeric
@attribute ATSC6i numeric
@attribute ATSC6m numeric
@attribute ATSC6p numeric
@attribute ATSC6s numeric
@attribute ATSC6v numeric
@attribute ATSC7e numeric
@attribute ATSC7i numeric
@attribute ATSC7m numeric
@attribute ATSC7p numeric
@attribute ATSC7s numeric
@attribute ATSC7v numeric
@attribute ATSC8e numeric
@attribute ATSC8i numeric
@attribute ATSC8m numeric
@attribute ATSC8p numeric
@attribute ATSC8s numeric
@attribute ATSC8v numeric
@attribute BAC numeric
@attribute BBI numeric
@attribute BIC0 numeric
@attribute BIC1 numeric
@attribute BIC2 numeric
@attribute BIC3 numeric
@attribute BIC4 numeric
@attribute BIC5 numeric
@attribute BID numeric
@attribute BLI numeric
@attribute BLTA96 numeric
@attribute BLTD48 numeric
@attribute BLTF96 numeric
@attribute C. numeric
@attribute C.001 numeric
@attribute C.002 numeric
@attribute C.003 numeric
@attribute C.005 numeric
@attribute C.006 numeric
@attribute C.008 numeric
@attribute C.011 numeric
@attribute C.013 numeric
@attribute C.017 numeric
@attribute C.018 numeric
@attribute C.024 numeric
@attribute C.025 numeric
@attribute C.026 numeric
@attribute C.039 numeric
@attribute CATS2D_01_AA numeric
@attribute CATS2D_01_AN numeric
@attribute CATS2D_01_AP numeric
@attribute CATS2D_01_DA numeric
@attribute CATS2D_01_DN numeric
@attribute CATS2D_01_LL numeric
@attribute CATS2D_01_NL numeric
@attribute CATS2D_02_AA numeric
@attribute CATS2D_02_AL numeric
@attribute CATS2D_02_DA numeric
@attribute CATS2D_02_DL numeric
@attribute CATS2D_02_LL numeric
@attribute CATS2D_02_PL numeric
@attribute CATS2D_03_AA numeric
@attribute CATS2D_03_AL numeric
@attribute CATS2D_03_AN numeric
@attribute CATS2D_03_AP numeric
@attribute CATS2D_03_DA numeric
@attribute CATS2D_03_DL numeric
@attribute CATS2D_03_LL numeric
@attribute CATS2D_03_NL numeric
@attribute CATS2D_03_PL numeric
@attribute CATS2D_04_AA numeric
@attribute CATS2D_04_AL numeric
@attribute CATS2D_04_AP numeric
@attribute CATS2D_04_DA numeric
@attribute CATS2D_04_DD numeric
@attribute CATS2D_04_DL numeric
@attribute CATS2D_04_DP numeric
@attribute CATS2D_04_LL numeric
@attribute CATS2D_04_NL numeric
@attribute CATS2D_04_PL numeric
@attribute CATS2D_05_AA numeric
@attribute CATS2D_05_AL numeric
@attribute CATS2D_05_AP numeric
@attribute CATS2D_05_DA numeric
@attribute CATS2D_05_DL numeric
@attribute CATS2D_05_LL numeric
@attribute CATS2D_05_NL numeric
@attribute CATS2D_05_PL numeric
@attribute CATS2D_06_AA numeric
@attribute CATS2D_06_AL numeric
@attribute CATS2D_06_AN numeric
@attribute CATS2D_06_AP numeric
@attribute CATS2D_06_DA numeric
@attribute CATS2D_06_DL numeric
@attribute CATS2D_06_LL numeric
@attribute CATS2D_06_PL numeric
@attribute CATS2D_07_AA numeric
@attribute CATS2D_07_AL numeric
@attribute CATS2D_07_AN numeric
@attribute CATS2D_07_AP numeric
@attribute CATS2D_07_DA numeric
@attribute CATS2D_07_DL numeric
@attribute CATS2D_07_PL numeric
@attribute CATS2D_08_AA numeric
@attribute CATS2D_08_AP numeric
@attribute CATS2D_08_DA numeric
@attribute CATS2D_08_DL numeric
@attribute CATS2D_08_PL numeric
@attribute CATS2D_09_AA numeric
@attribute CATS2D_09_AL numeric
@attribute CENT numeric
@attribute Chi0_AEA.bo. numeric
@attribute Chi0_AEA.dm. numeric
@attribute Chi0_AEA.ed. numeric
@attribute Chi0_AEA.ri. numeric
@attribute Chi0_EA numeric
@attribute Chi0_EA.bo. numeric
@attribute Chi0_EA.dm. numeric
@attribute Chi0_EA.ed. numeric
@attribute Chi0_EA.ri. numeric
@attribute Chi1_AEA.bo. numeric
@attribute Chi1_AEA.dm. numeric
@attribute Chi1_AEA.ed. numeric
@attribute Chi1_AEA.ri. numeric
@attribute Chi1_EA numeric
@attribute Chi1_EA.bo. numeric
@attribute Chi1_EA.dm. numeric
@attribute Chi1_EA.ed. numeric
@attribute Chi1_EA.ri. numeric
@attribute CIC0 numeric
@attribute CIC1 numeric
@attribute CIC2 numeric
@attribute CIC3 numeric
@attribute CIC4 numeric
@attribute CIC5 numeric
@attribute CID numeric
@attribute Cl.089 numeric
@attribute CSI numeric
@attribute DBI numeric
@attribute D.Dtr06 numeric
@attribute D.Dtr10 numeric
@attribute D.Dtr12 numeric
@attribute DECC numeric
@attribute DELS numeric
@attribute DLS_02 numeric
@attribute DLS_03 numeric
@attribute DLS_04 numeric
@attribute DLS_05 numeric
@attribute DLS_cons numeric
@attribute Dz numeric
@attribute ECC numeric
@attribute Eig01_AEA.bo. numeric
@attribute Eig01_AEA.dm. numeric
@attribute Eig01_AEA.ed. numeric
@attribute Eig01_AEA.ri. numeric
@attribute Eig01_EA numeric
@attribute Eig01_EA.bo. numeric
@attribute Eig01_EA.dm. numeric
@attribute Eig01_EA.ed. numeric
@attribute Eig01_EA.ri. numeric
@attribute Eig02_AEA.bo. numeric
@attribute Eig02_AEA.dm. numeric
@attribute Eig02_AEA.ed. numeric
@attribute Eig02_AEA.ri. numeric
@attribute Eig02_EA numeric
@attribute Eig02_EA.bo. numeric
@attribute Eig02_EA.dm. numeric
@attribute Eig02_EA.ed. numeric
@attribute Eig02_EA.ri. numeric
@attribute Eig03_AEA.bo. numeric
@attribute Eig03_AEA.dm. numeric
@attribute Eig03_AEA.ed. numeric
@attribute Eig03_AEA.ri. numeric
@attribute Eig03_EA numeric
@attribute Eig03_EA.bo. numeric
@attribute Eig03_EA.dm. numeric
@attribute Eig03_EA.ed. numeric
@attribute Eig03_EA.ri. numeric
@attribute Eig04_AEA.bo. numeric
@attribute Eig04_AEA.dm. numeric
@attribute Eig04_AEA.ed. numeric
@attribute Eig04_AEA.ri. numeric
@attribute Eig04_EA numeric
@attribute Eig04_EA.bo. numeric
@attribute Eig04_EA.dm. numeric
@attribute Eig04_EA.ed. numeric
@attribute Eig04_EA.ri. numeric
@attribute Eig05_AEA.bo. numeric
@attribute Eig05_AEA.dm. numeric
@attribute Eig05_AEA.ed. numeric
@attribute Eig05_AEA.ri. numeric
@attribute Eig05_EA numeric
@attribute Eig05_EA.bo. numeric
@attribute Eig05_EA.dm. numeric
@attribute Eig05_EA.ed. numeric
@attribute Eig05_EA.ri. numeric
@attribute Eig06_AEA.bo. numeric
@attribute Eig06_AEA.dm. numeric
@attribute Eig06_AEA.ed. numeric
@attribute Eig06_AEA.ri. numeric
@attribute Eig06_EA numeric
@attribute Eig06_EA.bo. numeric
@attribute Eig06_EA.ed. numeric
@attribute Eig06_EA.ri. numeric
@attribute Eig07_AEA.bo. numeric
@attribute Eig07_AEA.dm. numeric
@attribute Eig07_AEA.ed. numeric
@attribute Eig07_AEA.ri. numeric
@attribute Eig07_EA numeric
@attribute Eig07_EA.bo. numeric
@attribute Eig07_EA.ed. numeric
@attribute Eig07_EA.ri. numeric
@attribute Eig08_AEA.bo. numeric
@attribute Eig08_AEA.dm. numeric
@attribute Eig08_AEA.ed. numeric
@attribute Eig08_AEA.ri. numeric
@attribute Eig08_EA numeric
@attribute Eig08_EA.bo. numeric
@attribute Eig08_EA.ed. numeric
@attribute Eig08_EA.ri. numeric
@attribute Eig09_AEA.bo. numeric
@attribute Eig09_AEA.dm. numeric
@attribute Eig09_AEA.ed. numeric
@attribute Eig09_AEA.ri. numeric
@attribute Eig09_EA numeric
@attribute Eig09_EA.bo. numeric
@attribute Eig09_EA.ed. numeric
@attribute Eig09_EA.ri. numeric
@attribute Eig10_AEA.bo. numeric
@attribute Eig10_AEA.dm. numeric
@attribute Eig10_AEA.ed. numeric
@attribute Eig10_AEA.ri. numeric
@attribute Eig10_EA numeric
@attribute Eig10_EA.bo. numeric
@attribute Eig10_EA.ed. numeric
@attribute Eig10_EA.ri. numeric
@attribute Eig11_AEA.bo. numeric
@attribute Eig11_AEA.dm. numeric
@attribute Eig11_AEA.ed. numeric
@attribute Eig11_AEA.ri. numeric
@attribute Eig11_EA numeric
@attribute Eig11_EA.bo. numeric
@attribute Eig11_EA.ed. numeric
@attribute Eig11_EA.ri. numeric
@attribute Eig12_AEA.bo. numeric
@attribute Eig12_AEA.dm. numeric
@attribute Eig12_AEA.ed. numeric
@attribute Eig12_AEA.ri. numeric
@attribute Eig12_EA numeric
@attribute Eig12_EA.bo. numeric
@attribute Eig12_EA.dm. numeric
@attribute Eig12_EA.ed. numeric
@attribute Eig12_EA.ri. numeric
@attribute Eig13_AEA.bo. numeric
@attribute Eig13_AEA.dm. numeric
@attribute Eig13_AEA.ed. numeric
@attribute Eig13_AEA.ri. numeric
@attribute Eig13_EA numeric
@attribute Eig13_EA.bo. numeric
@attribute Eig13_EA.dm. numeric
@attribute Eig13_EA.ed. numeric
@attribute Eig13_EA.ri. numeric
@attribute Eig14_AEA.bo. numeric
@attribute Eig14_AEA.dm. numeric
@attribute Eig14_AEA.ed. numeric
@attribute Eig14_AEA.ri. numeric
@attribute Eig14_EA numeric
@attribute Eig14_EA.bo. numeric
@attribute Eig14_EA.dm. numeric
@attribute Eig14_EA.ed. numeric
@attribute Eig14_EA.ri. numeric
@attribute Eig15_AEA.bo. numeric
@attribute Eig15_AEA.dm. numeric
@attribute Eig15_AEA.ed. numeric
@attribute Eig15_AEA.ri. numeric
@attribute Eig15_EA numeric
@attribute Eig15_EA.bo. numeric
@attribute Eig15_EA.dm. numeric
@attribute Eig15_EA.ed. numeric
@attribute Eig15_EA.ri. numeric
@attribute Eta_alpha numeric
@attribute Eta_alpha_A numeric
@attribute Eta_B numeric
@attribute Eta_B_A numeric
@attribute Eta_beta numeric
@attribute Eta_beta_A numeric
@attribute Eta_betaP numeric
@attribute Eta_betaP_A numeric
@attribute Eta_betaS numeric
@attribute Eta_betaS_A numeric
@attribute Eta_C numeric
@attribute Eta_C_A numeric
@attribute Eta_epsi numeric
@attribute Eta_epsi_A numeric
@attribute Eta_F numeric
@attribute Eta_F_A numeric
@attribute Eta_FL numeric
@attribute Eta_FL_A numeric
@attribute Eta_L numeric
@attribute Eta_L_A numeric
@attribute Eta_sh_p numeric
@attribute Eta_sh_x numeric
@attribute Eta_sh_y numeric
@attribute F.083 numeric
@attribute F.084 numeric
@attribute GATS1e numeric
@attribute GATS1i numeric
@attribute GATS1m numeric
@attribute GATS1p numeric
@attribute GATS1s numeric
@attribute GATS1v numeric
@attribute GATS2e numeric
@attribute GATS2i numeric
@attribute GATS2m numeric
@attribute GATS2p numeric
@attribute GATS2s numeric
@attribute GATS2v numeric
@attribute GATS3e numeric
@attribute GATS3i numeric
@attribute GATS3m numeric
@attribute GATS3p numeric
@attribute GATS3s numeric
@attribute GATS3v numeric
@attribute GATS4e numeric
@attribute GATS4i numeric
@attribute GATS4m numeric
@attribute GATS4p numeric
@attribute GATS4s numeric
@attribute GATS4v numeric
@attribute GATS5e numeric
@attribute GATS5i numeric
@attribute GATS5m numeric
@attribute GATS5p numeric
@attribute GATS5s numeric
@attribute GATS5v numeric
@attribute GATS6e numeric
@attribute GATS6i numeric
@attribute GATS6m numeric
@attribute GATS6p numeric
@attribute GATS6s numeric
@attribute GATS6v numeric
@attribute GATS7e numeric
@attribute GATS7i numeric
@attribute GATS7m numeric
@attribute GATS7p numeric
@attribute GATS7s numeric
@attribute GATS7v numeric
@attribute GATS8e numeric
@attribute GATS8i numeric
@attribute GATS8m numeric
@attribute GATS8p numeric
@attribute GATS8s numeric
@attribute GATS8v numeric
@attribute GGI1 numeric
@attribute GGI10 numeric
@attribute GGI2 numeric
@attribute GGI3 numeric
@attribute GGI4 numeric
@attribute GGI5 numeric
@attribute GGI6 numeric
@attribute GGI7 numeric
@attribute GGI8 numeric
@attribute GGI9 numeric
@attribute GMTI numeric
@attribute GMTIV numeric
@attribute GNar numeric
@attribute H. numeric
@attribute H.046 numeric
@attribute H.047 numeric
@attribute H.048 numeric
@attribute H.050 numeric
@attribute H.052 numeric
@attribute HDcpx numeric
@attribute HNar numeric
@attribute HVcpx numeric
@attribute Hy numeric
@attribute Hypertens.80 numeric
@attribute Hypnotic.80 numeric
@attribute IAC numeric
@attribute IC0 numeric
@attribute IC1 numeric
@attribute IC2 numeric
@attribute IC3 numeric
@attribute IC4 numeric
@attribute IC5 numeric
@attribute ICR numeric
@attribute IDDE numeric
@attribute IDDM numeric
@attribute IDE numeric
@attribute IDET numeric
@attribute IDM numeric
@attribute IDMT numeric
@attribute ISIZ numeric
@attribute IVDE numeric
@attribute IVDM numeric
@attribute JGI1 numeric
@attribute JGI10 numeric
@attribute JGI2 numeric
@attribute JGI3 numeric
@attribute JGI4 numeric
@attribute JGI5 numeric
@attribute JGI6 numeric
@attribute JGI7 numeric
@attribute JGI8 numeric
@attribute JGI9 numeric
@attribute JGT numeric
@attribute LLS_01 numeric
@attribute LOC numeric
@attribute LPRS numeric
@attribute MATS1e numeric
@attribute MATS1i numeric
@attribute MATS1m numeric
@attribute MATS1p numeric
@attribute MATS1s numeric
@attribute MATS1v numeric
@attribute MATS2e numeric
@attribute MATS2i numeric
@attribute MATS2m numeric
@attribute MATS2p numeric
@attribute MATS2s numeric
@attribute MATS2v numeric
@attribute MATS3e numeric
@attribute MATS3i numeric
@attribute MATS3m numeric
@attribute MATS3p numeric
@attribute MATS3s numeric
@attribute MATS3v numeric
@attribute MATS4e numeric
@attribute MATS4i numeric
@attribute MATS4m numeric
@attribute MATS4p numeric
@attribute MATS4s numeric
@attribute MATS4v numeric
@attribute MATS5e numeric
@attribute MATS5i numeric
@attribute MATS5m numeric
@attribute MATS5p numeric
@attribute MATS5s numeric
@attribute MATS5v numeric
@attribute MATS6e numeric
@attribute MATS6i numeric
@attribute MATS6m numeric
@attribute MATS6p numeric
@attribute MATS6s numeric
@attribute MATS6v numeric
@attribute MATS7e numeric
@attribute MATS7i numeric
@attribute MATS7m numeric
@attribute MATS7p numeric
@attribute MATS7s numeric
@attribute MATS7v numeric
@attribute MATS8e numeric
@attribute MATS8i numeric
@attribute MATS8m numeric
@attribute MATS8p numeric
@attribute MATS8s numeric
@attribute MATS8v numeric
@attribute MAXDN numeric
@attribute MAXDP numeric
@attribute MCD numeric
@attribute MDDD numeric
@attribute Me numeric
@attribute Mi numeric
@attribute MLOGP numeric
@attribute MLOGP2 numeric
@attribute Mp numeric
@attribute MPC01 numeric
@attribute MPC02 numeric
@attribute MPC03 numeric
@attribute MPC04 numeric
@attribute MPC05 numeric
@attribute MPC06 numeric
@attribute MPC07 numeric
@attribute MPC08 numeric
@attribute MPC09 numeric
@attribute MPC10 numeric
@attribute MSD numeric
@attribute Mv numeric
@attribute MW numeric
@attribute MWC01 numeric
@attribute MWC02 numeric
@attribute MWC03 numeric
@attribute MWC04 numeric
@attribute MWC05 numeric
@attribute MWC06 numeric
@attribute MWC07 numeric
@attribute MWC08 numeric
@attribute MWC09 numeric
@attribute MWC10 numeric
@attribute N. numeric
@attribute N.066 numeric
@attribute N.068 numeric
@attribute N.069 numeric
@attribute N.071 numeric
@attribute N.072 numeric
@attribute NaaCH numeric
@attribute NaasC numeric
@attribute nArCO numeric
@attribute nArNHO numeric
@attribute nArNR2 numeric
@attribute nArOR numeric
@attribute nArX numeric
@attribute nAT numeric
@attribute nBM numeric
@attribute nBO numeric
@attribute nBT numeric
@attribute nC numeric
@attribute nCb. numeric
@attribute nCbH numeric
@attribute nCconj numeric
@attribute nCIC numeric
@attribute nCIR numeric
@attribute nCL numeric
@attribute nCp numeric
@attribute nCrs numeric
@attribute nCrt numeric
@attribute nCRX3 numeric
@attribute nCs numeric
@attribute nCsp2 numeric
@attribute nCsp3 numeric
@attribute nCt numeric
@attribute nDB numeric
@attribute NdO numeric
@attribute NdsCH numeric
@attribute NdssC numeric
@attribute Neoplastic.50 numeric
@attribute Neoplastic.80 numeric
@attribute nF numeric
@attribute nH numeric
@attribute nHAcc numeric
@attribute nHDon numeric
@attribute nHet numeric
@attribute nHM numeric
@attribute nN numeric
@attribute nN.N numeric
@attribute nO numeric
@attribute nR06 numeric
@attribute nR10 numeric
@attribute nR12 numeric
@attribute nRCOOH numeric
@attribute nR.Ct numeric
@attribute nRNH2 numeric
@attribute nROH numeric
@attribute NRS numeric
@attribute NsCH3 numeric
@attribute NsCl numeric
@attribute NsF numeric
@attribute nSK numeric
@attribute NsOH numeric
@attribute NssCH2 numeric
@attribute NssO numeric
@attribute NsssCH numeric
@attribute NsssN numeric
@attribute NssssC numeric
@attribute nX numeric
@attribute O. numeric
@attribute O.056 numeric
@attribute O.057 numeric
@attribute O.058 numeric
@attribute O.059 numeric
@attribute O.060 numeric
@attribute ON0 numeric
@attribute ON0V numeric
@attribute ON1 numeric
@attribute ON1V numeric
@attribute PCD numeric
@attribute PCR numeric
@attribute PDI numeric
@attribute PHI numeric
@attribute piID numeric
@attribute piPC01 numeric
@attribute piPC02 numeric
@attribute piPC03 numeric
@attribute piPC04 numeric
@attribute piPC05 numeric
@attribute piPC06 numeric
@attribute piPC07 numeric
@attribute piPC08 numeric
@attribute piPC09 numeric
@attribute piPC10 numeric
@attribute PJI2 numeric
@attribute Pol numeric
@attribute Psi_e_0 numeric
@attribute Psi_e_0d numeric
@attribute Psi_e_1 numeric
@attribute Psi_e_A numeric
@attribute Psi_i_0 numeric
@attribute Psi_i_0d numeric
@attribute Psi_i_1 numeric
@attribute Psi_i_1d numeric
@attribute Psi_i_A numeric
@attribute Psi_i_s numeric
@attribute Psi_i_t numeric
@attribute P_VSA_e_1 numeric
@attribute P_VSA_e_2 numeric
@attribute P_VSA_e_3 numeric
@attribute P_VSA_e_4 numeric
@attribute P_VSA_e_5 numeric
@attribute P_VSA_e_6 numeric
@attribute P_VSA_i_2 numeric
@attribute P_VSA_i_3 numeric
@attribute P_VSA_i_4 numeric
@attribute P_VSA_LogP_1 numeric
@attribute P_VSA_LogP_2 numeric
@attribute P_VSA_LogP_3 numeric
@attribute P_VSA_LogP_4 numeric
@attribute P_VSA_LogP_5 numeric
@attribute P_VSA_LogP_6 numeric
@attribute P_VSA_LogP_7 numeric
@attribute P_VSA_LogP_8 numeric
@attribute P_VSA_m_1 numeric
@attribute P_VSA_m_2 numeric
@attribute P_VSA_m_3 numeric
@attribute P_VSA_m_4 numeric
@attribute P_VSA_MR_1 numeric
@attribute P_VSA_MR_2 numeric
@attribute P_VSA_MR_3 numeric
@attribute P_VSA_MR_5 numeric
@attribute P_VSA_MR_6 numeric
@attribute P_VSA_MR_7 numeric
@attribute P_VSA_p_1 numeric
@attribute P_VSA_p_2 numeric
@attribute P_VSA_p_3 numeric
@attribute P_VSA_s_2 numeric
@attribute P_VSA_s_3 numeric
@attribute P_VSA_s_4 numeric
@attribute P_VSA_s_6 numeric
@attribute P_VSA_v_1 numeric
@attribute P_VSA_v_2 numeric
@attribute P_VSA_v_3 numeric
@attribute PW2 numeric
@attribute PW3 numeric
@attribute PW4 numeric
@attribute PW5 numeric
@attribute Qindex numeric
@attribute Ram numeric
@attribute RBF numeric
@attribute RBN numeric
@attribute Rbrid numeric
@attribute RCI numeric
@attribute RDCHI numeric
@attribute RDSQ numeric
@attribute RFD numeric
@attribute Rperim numeric
@attribute S0K numeric
@attribute S1K numeric
@attribute S2K numeric
@attribute S3K numeric
@attribute SAacc numeric
@attribute SaaCH numeric
@attribute SaasC numeric
@attribute SAdon numeric
@attribute SAtot numeric
@attribute SCBO numeric
@attribute SdO numeric
@attribute SdsCH numeric
@attribute SdssC numeric
@attribute Se numeric
@attribute Si numeric
@attribute SIC0 numeric
@attribute SIC1 numeric
@attribute SIC2 numeric
@attribute SIC3 numeric
@attribute SIC4 numeric
@attribute SIC5 numeric
@attribute SM02_AEA.bo. numeric
@attribute SM02_AEA.dm. numeric
@attribute SM02_AEA.ed. numeric
@attribute SM02_AEA.ri. numeric
@attribute SM02_EA numeric
@attribute SM02_EA.bo. numeric
@attribute SM02_EA.dm. numeric
@attribute SM02_EA.ed. numeric
@attribute SM02_EA.ri. numeric
@attribute SM03_AEA.bo. numeric
@attribute SM03_AEA.dm. numeric
@attribute SM03_AEA.ed. numeric
@attribute SM03_AEA.ri. numeric
@attribute SM03_EA numeric
@attribute SM03_EA.bo. numeric
@attribute SM03_EA.dm. numeric
@attribute SM03_EA.ed. numeric
@attribute SM03_EA.ri. numeric
@attribute SM04_AEA.bo. numeric
@attribute SM04_AEA.dm. numeric
@attribute SM04_AEA.ed. numeric
@attribute SM04_AEA.ri. numeric
@attribute SM04_EA numeric
@attribute SM04_EA.bo. numeric
@attribute SM04_EA.dm. numeric
@attribute SM04_EA.ed. numeric
@attribute SM04_EA.ri. numeric
@attribute SM05_AEA.bo. numeric
@attribute SM05_AEA.dm. numeric
@attribute SM05_AEA.ed. numeric
@attribute SM05_AEA.ri. numeric
@attribute SM05_EA numeric
@attribute SM05_EA.bo. numeric
@attribute SM05_EA.dm. numeric
@attribute SM05_EA.ed. numeric
@attribute SM05_EA.ri. numeric
@attribute SM06_AEA.bo. numeric
@attribute SM06_AEA.dm. numeric
@attribute SM06_AEA.ed. numeric
@attribute SM06_AEA.ri. numeric
@attribute SM06_EA numeric
@attribute SM06_EA.bo. numeric
@attribute SM06_EA.dm. numeric
@attribute SM06_EA.ed. numeric
@attribute SM06_EA.ri. numeric
@attribute SM07_AEA.bo. numeric
@attribute SM07_AEA.dm. numeric
@attribute SM07_AEA.ed. numeric
@attribute SM07_AEA.ri. numeric
@attribute SM07_EA numeric
@attribute SM07_EA.bo. numeric
@attribute SM07_EA.dm. numeric
@attribute SM07_EA.ed. numeric
@attribute SM07_EA.ri. numeric
@attribute SM08_AEA.bo. numeric
@attribute SM08_AEA.dm. numeric
@attribute SM08_AEA.ed. numeric
@attribute SM08_AEA.ri. numeric
@attribute SM08_EA numeric
@attribute SM08_EA.bo. numeric
@attribute SM08_EA.dm. numeric
@attribute SM08_EA.ed. numeric
@attribute SM08_EA.ri. numeric
@attribute SM09_AEA.bo. numeric
@attribute SM09_AEA.dm. numeric
@attribute SM09_AEA.ed. numeric
@attribute SM09_AEA.ri. numeric
@attribute SM09_EA numeric
@attribute SM09_EA.bo. numeric
@attribute SM09_EA.dm. numeric
@attribute SM09_EA.ed. numeric
@attribute SM09_EA.ri. numeric
@attribute SM10_AEA.bo. numeric
@attribute SM10_AEA.dm. numeric
@attribute SM10_AEA.ed. numeric
@attribute SM10_AEA.ri. numeric
@attribute SM10_EA numeric
@attribute SM10_EA.bo. numeric
@attribute SM10_EA.dm. numeric
@attribute SM10_EA.ed. numeric
@attribute SM10_EA.ri. numeric
@attribute SM11_AEA.bo. numeric
@attribute SM11_AEA.dm. numeric
@attribute SM11_AEA.ed. numeric
@attribute SM11_AEA.ri. numeric
@attribute SM11_EA numeric
@attribute SM11_EA.bo. numeric
@attribute SM11_EA.dm. numeric
@attribute SM11_EA.ed. numeric
@attribute SM11_EA.ri. numeric
@attribute SM12_AEA.bo. numeric
@attribute SM12_AEA.dm. numeric
@attribute SM12_AEA.ed. numeric
@attribute SM12_AEA.ri. numeric
@attribute SM12_EA numeric
@attribute SM12_EA.bo. numeric
@attribute SM12_EA.dm. numeric
@attribute SM12_EA.ed. numeric
@attribute SM12_EA.ri. numeric
@attribute SM13_AEA.bo. numeric
@attribute SM13_AEA.dm. numeric
@attribute SM13_AEA.ed. numeric
@attribute SM13_AEA.ri. numeric
@attribute SM13_EA numeric
@attribute SM13_EA.bo. numeric
@attribute SM13_EA.dm. numeric
@attribute SM13_EA.ed. numeric
@attribute SM13_EA.ri. numeric
@attribute SM14_AEA.bo. numeric
@attribute SM14_AEA.dm. numeric
@attribute SM14_AEA.ed. numeric
@attribute SM14_AEA.ri. numeric
@attribute SM14_EA numeric
@attribute SM14_EA.bo. numeric
@attribute SM14_EA.dm. numeric
@attribute SM14_EA.ed. numeric
@attribute SM14_EA.ri. numeric
@attribute SM15_AEA.bo. numeric
@attribute SM15_AEA.dm. numeric
@attribute SM15_AEA.ed. numeric
@attribute SM15_AEA.ri. numeric
@attribute SM15_EA numeric
@attribute SM15_EA.bo. numeric
@attribute SM15_EA.dm. numeric
@attribute SM15_EA.ed. numeric
@attribute SM15_EA.ri. numeric
@attribute SMTI numeric
@attribute SMTIV numeric
@attribute SNar numeric
@attribute Sp numeric
@attribute SpAD_AEA.bo. numeric
@attribute SpAD_AEA.dm. numeric
@attribute SpAD_AEA.ed. numeric
@attribute SpAD_AEA.ri. numeric
@attribute SpAD_EA numeric
@attribute SpAD_EA.bo. numeric
@attribute SpAD_EA.dm. numeric
@attribute SpAD_EA.ed. numeric
@attribute SpAD_EA.ri. numeric
@attribute SpDiam_AEA.bo. numeric
@attribute SpDiam_AEA.dm. numeric
@attribute SpDiam_AEA.ed. numeric
@attribute SpDiam_AEA.ri. numeric
@attribute SpDiam_EA numeric
@attribute SpDiam_EA.bo. numeric
@attribute SpDiam_EA.dm. numeric
@attribute SpDiam_EA.ed. numeric
@attribute SpDiam_EA.ri. numeric
@attribute SPI numeric
@attribute SpMAD_AEA.bo. numeric
@attribute SpMAD_AEA.dm. numeric
@attribute SpMAD_AEA.ed. numeric
@attribute SpMAD_AEA.ri. numeric
@attribute SpMAD_EA numeric
@attribute SpMAD_EA.bo. numeric
@attribute SpMAD_EA.dm. numeric
@attribute SpMAD_EA.ed. numeric
@attribute SpMAD_EA.ri. numeric
@attribute SpMax1_Bh.e. numeric
@attribute SpMax1_Bh.i. numeric
@attribute SpMax1_Bh.m. numeric
@attribute SpMax1_Bh.p. numeric
@attribute SpMax1_Bh.s. numeric
@attribute SpMax1_Bh.v. numeric
@attribute SpMax2_Bh.e. numeric
@attribute SpMax2_Bh.i. numeric
@attribute SpMax2_Bh.m. numeric
@attribute SpMax2_Bh.p. numeric
@attribute SpMax2_Bh.s. numeric
@attribute SpMax2_Bh.v. numeric
@attribute SpMax3_Bh.e. numeric
@attribute SpMax3_Bh.i. numeric
@attribute SpMax3_Bh.m. numeric
@attribute SpMax3_Bh.p. numeric
@attribute SpMax3_Bh.s. numeric
@attribute SpMax3_Bh.v. numeric
@attribute SpMax4_Bh.e. numeric
@attribute SpMax4_Bh.i. numeric
@attribute SpMax4_Bh.m. numeric
@attribute SpMax4_Bh.p. numeric
@attribute SpMax4_Bh.s. numeric
@attribute SpMax4_Bh.v. numeric
@attribute SpMax5_Bh.e. numeric
@attribute SpMax5_Bh.i. numeric
@attribute SpMax5_Bh.m. numeric
@attribute SpMax5_Bh.p. numeric
@attribute SpMax5_Bh.s. numeric
@attribute SpMax5_Bh.v. numeric
@attribute SpMax6_Bh.e. numeric
@attribute SpMax6_Bh.i. numeric
@attribute SpMax6_Bh.m. numeric
@attribute SpMax6_Bh.p. numeric
@attribute SpMax6_Bh.s. numeric
@attribute SpMax6_Bh.v. numeric
@attribute SpMax7_Bh.e. numeric
@attribute SpMax7_Bh.i. numeric
@attribute SpMax7_Bh.m. numeric
@attribute SpMax7_Bh.p. numeric
@attribute SpMax7_Bh.s. numeric
@attribute SpMax7_Bh.v. numeric
@attribute SpMax8_Bh.e. numeric
@attribute SpMax8_Bh.i. numeric
@attribute SpMax8_Bh.m. numeric
@attribute SpMax8_Bh.p. numeric
@attribute SpMax8_Bh.s. numeric
@attribute SpMax8_Bh.v. numeric
@attribute SpMaxA_AEA.bo. numeric
@attribute SpMaxA_AEA.dm. numeric
@attribute SpMaxA_AEA.ed. numeric
@attribute SpMaxA_AEA.ri. numeric
@attribute SpMaxA_EA numeric
@attribute SpMax_AEA.bo. numeric
@attribute SpMaxA_EA.bo. numeric
@attribute SpMax_AEA.dm. numeric
@attribute SpMaxA_EA.dm. numeric
@attribute SpMax_AEA.ed. numeric
@attribute SpMaxA_EA.ed. numeric
@attribute SpMax_AEA.ri. numeric
@attribute SpMaxA_EA.ri. numeric
@attribute SpMax_EA numeric
@attribute SpMax_EA.bo. numeric
@attribute SpMax_EA.dm. numeric
@attribute SpMax_EA.ed. numeric
@attribute SpMax_EA.ri. numeric
@attribute SpMin1_Bh.e. numeric
@attribute SpMin1_Bh.i. numeric
@attribute SpMin1_Bh.m. numeric
@attribute SpMin1_Bh.p. numeric
@attribute SpMin1_Bh.s. numeric
@attribute SpMin1_Bh.v. numeric
@attribute SpMin2_Bh.e. numeric
@attribute SpMin2_Bh.i. numeric
@attribute SpMin2_Bh.m. numeric
@attribute SpMin2_Bh.p. numeric
@attribute SpMin2_Bh.s. numeric
@attribute SpMin2_Bh.v. numeric
@attribute SpMin3_Bh.e. numeric
@attribute SpMin3_Bh.i. numeric
@attribute SpMin3_Bh.m. numeric
@attribute SpMin3_Bh.p. numeric
@attribute SpMin3_Bh.s. numeric
@attribute SpMin3_Bh.v. numeric
@attribute SpMin4_Bh.e. numeric
@attribute SpMin4_Bh.i. numeric
@attribute SpMin4_Bh.m. numeric
@attribute SpMin4_Bh.p. numeric
@attribute SpMin4_Bh.s. numeric
@attribute SpMin4_Bh.v. numeric
@attribute SpMin5_Bh.e. numeric
@attribute SpMin5_Bh.i. numeric
@attribute SpMin5_Bh.m. numeric
@attribute SpMin5_Bh.p. numeric
@attribute SpMin5_Bh.s. numeric
@attribute SpMin5_Bh.v. numeric
@attribute SpMin6_Bh.e. numeric
@attribute SpMin6_Bh.i. numeric
@attribute SpMin6_Bh.m. numeric
@attribute SpMin6_Bh.p. numeric
@attribute SpMin6_Bh.s. numeric
@attribute SpMin6_Bh.v. numeric
@attribute SpMin7_Bh.e. numeric
@attribute SpMin7_Bh.i. numeric
@attribute SpMin7_Bh.m. numeric
@attribute SpMin7_Bh.p. numeric
@attribute SpMin7_Bh.s. numeric
@attribute SpMin7_Bh.v. numeric
@attribute SpMin8_Bh.e. numeric
@attribute SpMin8_Bh.i. numeric
@attribute SpMin8_Bh.m. numeric
@attribute SpMin8_Bh.p. numeric
@attribute SpMin8_Bh.s. numeric
@attribute SpMin8_Bh.v. numeric
@attribute SRW02 numeric
@attribute SRW04 numeric
@attribute SRW06 numeric
@attribute SRW08 numeric
@attribute SRW10 numeric
@attribute SsCH3 numeric
@attribute SsCl numeric
@attribute SsF numeric
@attribute SsNH2 numeric
@attribute SsOH numeric
@attribute SssCH2 numeric
@attribute SssO numeric
@attribute SsssCH numeric
@attribute SsssN numeric
@attribute SssssC numeric
@attribute Sv numeric
@attribute TIC0 numeric
@attribute TIC1 numeric
@attribute TIC2 numeric
@attribute TIC3 numeric
@attribute TIC4 numeric
@attribute TIC5 numeric
@attribute TIE numeric
@attribute TPC numeric
@attribute TPSA.NO. numeric
@attribute TPSA.Tot. numeric
@attribute TRS numeric
@attribute TWC numeric
@attribute Uc numeric
@attribute Ui numeric
@attribute Uindex numeric
@attribute UNIP numeric
@attribute VAR numeric
@attribute Vindex numeric
@attribute VvdwMG numeric
@attribute VvdwZAZ numeric
@attribute Vx numeric
@attribute Wap numeric
@attribute X. numeric
@attribute X0 numeric
@attribute X0A numeric
@attribute X0Av numeric
@attribute X0sol numeric
@attribute X0v numeric
@attribute X1 numeric
@attribute X1A numeric
@attribute X1Av numeric
@attribute X1Kup numeric
@attribute X1Mad numeric
@attribute X1MulPer numeric
@attribute X1Per numeric
@attribute X1sol numeric
@attribute X1v numeric
@attribute X2 numeric
@attribute X2A numeric
@attribute X2Av numeric
@attribute X2sol numeric
@attribute X2v numeric
@attribute X3 numeric
@attribute X3A numeric
@attribute X3Av numeric
@attribute X3sol numeric
@attribute X3v numeric
@attribute X4 numeric
@attribute X4A numeric
@attribute X4Av numeric
@attribute X4sol numeric
@attribute X4v numeric
@attribute X5 numeric
@attribute X5A numeric
@attribute X5Av numeric
@attribute X5sol numeric
@attribute X5v numeric
@attribute Xindex numeric
@attribute XMOD numeric
@attribute Xt numeric
@attribute Xu numeric
@attribute Yindex numeric
@attribute ZM1 numeric
@attribute ZM1Kup numeric
@attribute ZM1Mad numeric
@attribute ZM1MulPer numeric
@attribute ZM1Per numeric
@attribute ZM1V numeric
@attribute ZM2 numeric
@attribute ZM2Kup numeric
@attribute ZM2Mad numeric
@attribute ZM2MulPer numeric
@attribute ZM2Per numeric
@attribute ZM2V numeric
@attribute pXC50 numeric

@data
{1 1.799,2 8.923,3 0.938,4 0.88,5 94.523,6 8.053,7 0.207,8 3.955,9 4.069,10 3.572,11 3.392,12 5.142,13 3.423,14 4.528,15 4.696,16 3.998,17 3.826,18 5.735,19 3.851,20 4.828,21 5.015,22 4.18,23 4.056,24 6.018,25 4.059,26 4.95,27 5.141,28 4.212,29 4.093,30 6.291,31 4.074,32 4.911,33 5.11,34 4.137,35 4.012,36 6.215,37 4.004,38 4.816,39 4.997,40 3.975,41 3.87,42 6.127,43 3.864,44 4.782,45 5.002,46 3.747,47 3.693,48 6.261,49 3.643,50 4.519,51 4.785,52 3.216,53 3.434,54 5.594,55 3.314,56 0.203,57 0.756,58 8.524,59 3.851,60 22.056,61 4.693,62 0.545,63 1.227,64 18,65 6.05,66 54.003,67 8.044,68 0.787,69 1.574,70 25.584,71 8.595,72 60.39,73 11.318,74 1.162,75 1.634,76 30.937,77 10.77,78 141.458,79 13.906,80 1.124,81 1.669,82 30.752,83 10.137,84 136.011,85 12.704,86 0.999,87 1.492,88 26.992,89 8.647,90 105.202,91 10.369,92 1.415,93 1.18,94 29.468,95 7.773,96 205.161,97 10.455,98 0.822,99 0.904,100 23.587,101 6.503,102 98.708,103 9.133,104 38,105 44,106 0.313,107 0.687,108 0.812,109 0.843,110 0.843,111 0.843,112 3.306,113 0.869,114 -2.21,115 -2.25,116 -2.22,117 37.8,118 1,122 5,123 1,126 1,127 1,128 1,129 1,130 4,131 1,133 1,134 1,135 1,136 1,137 1,138 1,140 6,141 1,142 1,143 1,145 3,146 5,147 2,151 1,152 1,154 4,155 3,156 1,157 3,159 1,161 2,162 1,164 1,165 2,168 1,169 1,170 1,172 2,173 5,174 1,177 1,180 2,181 1,182 1,183 1,184 2,185 1,186 1,187 1,188 1,189 2,190 1,191 1,192 1,193 2,194 836,195 17.137,196 17.137,197 17.137,198 17.137,199 17.137,200 15.977,201 27.903,202 9.612,203 17.575,204 14.251,205 14.251,206 14.251,207 14.251,208 14.251,209 12.223,210 42.902,211 4.516,212 14.962,213 3.693,214 1.54,215 0.817,216 0.639,217 0.639,218 0.639,219 3.997,221 501,222 2.915,223 210.135,224 250.17,225 104.165,226 1.473,227 48.632,228 1,229 1,230 1,231 1,232 1,233 59.5,234 232,235 4.727,236 3.819,237 7.164,238 4.386,239 3.42,240 4.404,241 1.437,242 12.559,243 3.314,244 4.29,245 3.551,246 6.632,247 3.959,248 2.992,249 3.724,250 0.86,251 10.515,252 2.892,253 3.878,254 3.301,255 6.272,256 3.668,257 2.708,258 3.132,259 0.8,260 9.141,261 2.571,262 3.681,263 3.142,264 5.812,265 3.426,266 2.472,267 2.914,268 0.8,269 7.747,270 2.36,271 3.434,272 2.743,273 5.341,274 3.248,275 2.279,276 2.473,277 0.4,278 6.442,279 2.191,280 3.226,281 2.484,282 5.179,283 2.898,284 1.96,285 2.354,286 6.059,287 1.832,288 3.021,289 2.327,290 4.842,291 2.753,292 1.822,293 2.055,294 5.241,295 1.682,296 2.763,297 2.173,298 4.627,299 2.512,300 1.577,301 1.762,302 4.367,303 1.454,304 2.706,305 1.71,306 4.189,307 2.287,308 1.293,309 1.648,310 3.368,311 1.265,312 2.031,313 1.378,314 3.512,315 1.967,316 1,317 1,318 2.275,319 0.965,320 2,321 1.146,322 3.414,323 1.564,324 0.617,325 0.76,326 1.596,327 0.573,328 1.493,329 0.895,330 3.238,331 1.154,332 0.174,333 0.222,335 0.439,336 0.165,337 1.14,338 0.505,339 2.978,340 0.941,341 -0.019,342 -0.021,344 -0.046,345 -0.018,346 0.963,347 0.32,348 2.771,349 0.705,350 -0.238,351 -0.267,353 -0.651,354 -0.221,355 0.672,356 0.12,357 2.457,358 0.467,359 -0.498,360 -0.55,362 -1.327,363 -0.473,364 11.719,365 0.451,366 0.878,367 0.034,368 30,369 1.154,370 12,371 0.462,372 18,373 0.692,374 24.594,375 0.946,376 29.681,377 0.66,378 24.978,379 0.961,380 5.955,381 0.229,382 6.425,383 0.247,384 0.187,386 0.486,388 1,389 0.747,390 1.251,391 0.707,392 1.15,393 0.636,394 0.956,395 0.813,396 1.069,397 0.748,398 0.883,399 0.47,400 0.783,401 0.841,402 0.944,403 0.87,404 0.968,405 0.713,406 0.917,407 0.753,408 0.983,409 0.83,410 1.05,411 0.753,412 0.993,413 1.085,414 1.217,415 0.94,416 1.08,417 0.981,418 0.991,419 1.404,420 1.395,421 1.276,422 1.316,423 1.424,424 1.273,425 1.093,426 0.911,427 1.192,428 0.969,429 1.236,430 1.095,431 1.072,432 0.987,433 1.207,434 1.009,435 1.163,436 1.13,437 5.5,438 0.058,439 3.778,440 2.625,441 2.778,442 1.479,443 1.051,444 0.45,445 0.263,446 0.167,447 6643,448 21555,449 2.055,450 42.2,452 12,453 1,454 3,455 3,456 1.699,457 1.857,458 3.091,459 1.05,460 1,462 80.936,463 1.799,464 3.952,465 4.675,466 4.853,467 4.853,468 4.853,469 2.716,470 3.844,471 4.668,472 3.219,473 1046.32,474 8.135,475 12073,476 247.133,477 1.526,478 4.598,479 0.19,480 0.007,481 0.086,482 0.051,483 0.056,484 0.032,485 0.028,486 0.017,487 0.016,488 0.014,489 0.497,490 0.5,491 0.85,492 122.609,493 -0.08,494 -0.114,495 0.032,496 -0.035,497 -0.064,498 0.021,499 -0.069,500 -0.025,501 0.093,502 0.132,503 0.097,504 0.176,505 -0.039,506 0.107,507 0.01,508 0.04,509 -0.016,510 0.052,511 0.167,512 -0.014,513 0.109,514 -0.018,515 0.117,516 0.013,517 0.001,518 -0.064,519 0.045,520 -0.038,521 0.023,522 0.009,523 -0.195,524 -0.17,525 -0.294,526 -0.298,527 -0.19,528 -0.326,529 0.093,530 0.038,531 -0.138,532 -0.038,533 0.088,534 -0.146,535 -0.085,536 0.011,537 -0.151,538 -0.051,539 -0.145,540 -0.114,541 2.996,542 6.952,543 0.731,544 20.166,545 1.029,546 1.144,547 0.975,548 0.951,549 0.642,550 3.401,551 3.807,552 4.159,553 4.511,554 4.868,555 5.069,556 5.278,557 5.403,558 5.557,559 5.568,560 5.179,561 0.634,562 362.4,563 3.401,564 4.99,565 5.889,566 6.819,567 7.743,568 8.681,569 9.615,570 10.557,571 11.496,572 12.439,573 8.9,575 1,576 1,577 2,579 1,580 5,581 1,583 2,584 1,585 1,586 45,587 9,588 29,589 48,590 17,591 5,592 1,593 4,594 4,595 8,597 1,598 1,601 1,602 10,603 7,605 3,606 2,607 1,608 3,609 1,610 1,611 1,612 19,613 9,614 3,615 9,617 4,618 1,619 4,620 4,621 3,622 1,623 1,624 1,626 1,627 2,628 1,630 1,631 26,632 1,633 5,634 1,635 1,636 3,638 1,639 8.9,641 1,642 2,644 1,645 14,646 8.276,647 5.528,648 2.682,649 1.821,650 1.232,651 0.97,652 4.235,653 9.667,654 3.584,655 4.167,656 4.76,657 5.331,658 5.906,659 6.32,660 6.721,661 7.023,662 7.349,663 7.448,664 1,665 51,666 9.792,668 4.525,669 8.179,670 17.94,672 15.393,674 2.679,675 69.667,677 188.338,678 72.657,679 42.025,681 103.973,682 14.96,683 72.657,684 292.311,685 56.985,686 8.825,687 22.063,688 42.251,689 99.017,690 46.499,691 26.731,692 176.567,694 188.338,695 114.682,696 118.933,698 167.984,699 139.286,701 24.842,702 89.839,704 203.298,705 145.998,706 72.657,707 188.338,708 45.308,709 36.599,710 151.708,711 188.338,712 160.958,713 72.657,714 0.604,715 0.366,716 0.204,717 0.125,718 24,719 12,720 0.042,721 2,722 3,723 1.263,724 3.505,725 244.222,726 0.316,727 18,728 118.211,729 17.428,730 6.318,731 2.735,732 160.958,733 1.121,734 0.445,735 75.458,736 421.952,737 35,738 23.961,739 1.323,740 -2.412,741 46.298,742 51.492,743 0.327,744 0.72,745 0.851,746 0.884,747 0.884,748 0.884,749 4.902,750 1.577,751 5.927,752 5.241,753 4.489,754 4.852,755 2.18,756 6.843,757 4.399,758 6.121,759 1.293,760 7.556,761 4.367,762 4.29,763 4.856,764 0.57,765 7.945,766 4.171,767 7.459,768 1,769 9.285,770 3.368,771 6.184,772 7.008,773 2.45,774 11.115,775 6.019,776 8.829,777 0.617,778 11.07,779 2.275,780 6.758,781 7.815,782 0.479,783 13.03,784 6.573,785 10.233,786 0.174,787 12.891,788 1.596,789 8.187,790 9.523,791 2.993,792 15.752,793 7.96,794 11.661,795 -0.019,796 14.737,797 0.439,798 9.107,799 10.688,800 0.346,801 18.011,802 8.86,803 13.11,804 -0.238,805 16.603,806 -0.046,807 10.374,808 12.241,809 3.644,810 20.586,811 10.091,812 3.42,813 -0.498,814 18.483,815 -0.651,816 11.451,817 13.569,818 0.237,819 22.992,820 11.145,821 2.992,822 12.559,823 20.375,824 -1.327,825 12.666,826 15.067,827 4.338,828 25.52,829 12.327,830 2.708,831 10.515,832 22.277,833 4.404,834 13.815,835 16.47,836 0.158,837 27.989,838 13.449,839 2.472,840 9.141,841 24.187,842 3.724,843 15.018,844 17.95,845 5.05,846 30.506,847 14.622,848 2.279,849 7.747,850 26.104,851 3.132,852 16.2,853 19.389,854 0.104,855 33.004,856 15.776,857 1.96,858 6.442,859 28.026,860 2.914,861 17.405,862 20.864,863 5.77,864 35.521,865 16.951,866 1.822,867 6.059,868 29.954,869 2.473,870 18.605,871 22.321,872 0.068,873 38.032,874 18.121,875 6478,876 11796,877 18.729,878 28.87,879 45.537,880 47.51,881 47.619,882 44.719,883 44.626,884 52.896,885 8.593,886 139.495,887 42.529,888 5.727,889 5.819,890 6.579,891 5.495,892 5.42,893 7.404,894 2.873,895 20.301,896 5.314,897 15.497,898 1.57,899 1.638,900 1.642,901 1.542,902 1.539,903 1.824,904 0.296,905 4.81,906 1.467,907 4.077,908 4.101,909 4.053,910 3.963,911 8.201,912 3.982,913 3.798,914 3.869,915 3.708,916 3.596,917 7.48,918 3.614,919 3.579,920 3.621,921 3.533,922 3.422,923 7.422,924 3.436,925 3.564,926 3.584,927 3.449,928 3.394,929 6.351,930 3.402,931 3.147,932 3.214,933 3.1,934 2.941,935 5.049,936 2.91,937 3.111,938 3.206,939 2.871,940 2.851,941 4.797,942 2.899,943 2.994,944 3.071,945 2.866,946 2.748,947 4.236,948 2.765,949 2.989,950 3.032,951 2.823,952 2.596,953 4.215,954 2.643,955 0.163,956 0.132,957 0.247,958 0.151,959 0.118,960 4.727,961 0.152,962 3.819,963 0.05,964 7.164,965 0.433,966 4.386,967 0.114,968 3.42,969 4.404,970 1.437,971 12.559,972 3.314,973 1.99,974 1.973,975 2.056,976 2.128,977 1.312,978 2.106,979 1.736,980 1.67,981 1.935,982 1.972,983 1.219,984 1.965,985 1.545,986 1.489,987 1.77,988 1.73,989 0.987,990 1.742,991 1.481,992 1.469,993 1.561,994 1.677,995 0.825,996 1.634,997 1.153,998 1.064,999 1.513,1000 1.376,1001 0.652,1002 1.429,1003 0.999,1004 0.948,1005 1.34,1006 1.374,1007 0.461,1008 1.346,1009 0.943,1010 0.865,1011 1.26,1012 1.271,1013 0.342,1014 1.292,1015 0.8,1016 0.743,1017 0.992,1018 1.206,1019 0.054,1020 1.133,1021 4.078,1022 5.46,1023 7.054,1024 8.753,1025 10.513,1026 1.856,1028 14.952,1029 5.773,1030 9.308,1031 2.484,1032 5.822,1033 -0.178,1034 5.212,1036 28.543,1037 80.936,1038 177.83,1039 210.379,1040 218.379,1041 218.379,1042 218.379,1043 66.703,1044 7.846,1045 101.03,1046 101.03,1047 24,1048 12.933,1049 3.322,1050 2.807,1051 37.706,1052 82,1053 94,1054 0.242,1055 171.063,1056 311.71,1057 409.153,1058 24502,1059 2.2,1060 18.585,1061 0.715,1062 0.548,1063 17.715,1064 14.236,1065 12.38,1066 0.427,1067 0.29,1068 8.209,1069 11.604,1070 8.079,1071 6.576,1072 11.969,1073 8.402,1074 11.937,1075 0.271,1076 0.152,1077 11.387,1078 6.7,1079 10.321,1080 0.164,1081 0.079,1082 9.97,1083 5.003,1084 8.974,1085 0.1,1086 0.04,1087 8.513,1088 3.604,1089 7.953,1090 0.062,1091 0.021,1092 7.51,1093 2.766,1094 0.36,1095 79.884,1096 0.231,1097 24.114,1098 0.731,1099 146,1100 535.715,1101 167.843,1102 477.339,1103 633.06,1104 442,1105 180,1106 457.024,1107 203.519,1108 449.542,1109 671.34,1110 422,1111 6}
{0 CHEMBL2047851,1 1.665,2 5,3 -0.051,4 0.003,5 47.394,6 7.748,7 0.429,8 3.272,9 3.39,10 2.85,11 2.768,12 4.513,13 2.77,14 3.746,15 3.892,16 3.216,17 3.162,18 4.916,19 3.145,20 4.069,21 4.254,22 3.347,23 3.265,24 5.483,25 3.239,26 4.06,27 4.272,28 3.032,29 3.066,30 5.383,31 3.019,32 3.773,33 4.009,34 2.469,35 2.694,36 5.026,37 2.591,38 3.318,39 3.642,40 1.566,41 2.062,42 4.357,43 1.853,44 2.356,45 2.72,46 0.351,47 1.113,48 3.091,49 0.846,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.113,57 0.344,58 4.654,59 1.926,60 12.988,61 2.454,62 0.129,63 0.536,64 7.8,65 3.266,66 15.991,67 4.337,68 0.334,69 0.645,70 12.333,71 4.187,72 59.594,73 5.727,74 0.377,75 0.555,76 13.516,77 3.772,78 56.468,79 5.126,80 0.283,81 0.384,82 10.633,83 2.951,84 43.469,85 4.064,86 0.178,87 0.216,88 7.54,89 1.88,90 29.643,91 2.989,92 0.071,93 0.07,94 2.965,95 0.686,96 12.244,97 1.171,98 0.011,99 0.011,100 0.63,101 0.146,102 1.802,103 0.275,104 10,105 20,106 0.346,107 0.735,108 0.814,109 0.887,110 0.905,111 0.905,112 2.672,113 0.871,114 -1.95,115 -2.01,116 -2,117 39.1,119 1,123 1,128 4,129 1,130 1,135 1,137 5,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 4,153 1,155 3,158 1,159 4,160 1,161 1,163 1,165 2,168 3,171 2,173 1,177 1,179 1,194 102,195 8.552,196 8.552,197 8.552,198 8.552,199 8.552,200 7.72,201 9.276,202 4.924,203 8.635,204 6.853,205 6.853,206 6.853,207 6.853,208 6.853,209 5.525,210 8.394,211 2.297,212 6.958,213 2.859,214 0.989,215 0.609,216 0.261,217 0.174,218 0.174,219 3.303,221 135,222 1.581,223 51.529,224 44.341,226 0.615,227 18.35,228 0.67,229 0.83,230 0.8,232 0.76,233 29,234 65,235 4.407,236 4.326,237 6.699,238 4.143,239 3.165,240 3.919,241 2.291,242 10.688,243 3.089,244 3.763,245 3.326,246 5.83,247 3.427,248 2.424,249 3.043,250 1.257,251 7.667,252 2.425,253 3.152,254 2.854,255 5.181,256 2.995,257 2.027,258 2.255,259 0.08,260 6.002,261 1.958,262 2.889,263 2.006,264 3.872,265 2.427,266 1.427,267 2.053,269 3.056,270 1.427,271 2.444,272 1.476,273 3.653,274 2.067,275 1.073,276 1.41,278 2.703,279 1.063,280 1.827,281 1.405,282 3.099,283 1.425,284 0.367,285 0.476,286 0.825,287 0.383,288 1.083,289 0.437,290 2.631,291 0.855,292 -0.125,293 -0.143,294 -0.304,295 -0.122,296 0.604,297 -0.083,298 2,299 0.187,300 -0.799,301 -0.976,302 -1.916,303 -0.785,304 0.313,305 -0.528,306 1.724,307 -0.017,308 -1,309 -1.292,310 -2.433,311 -0.982,313 -0.872,314 1.525,315 -0.253,316 -1.299,317 -1.619,318 -3.288,319 -1.35,320 -0.448,321 -1.022,322 1.231,323 -0.558,324 -1.522,325 -1.798,326 -4.485,327 -1.478,328 -0.5,329 -1.496,330 1.209,331 -0.76,332 -1.737,333 -2.143,334 -0.67,335 -5.294,336 -1.681,337 -0.588,338 -1.668,339 1.027,340 -1,341 -2,342 -2.185,343 -1.313,344 -5.722,345 -1.946,346 -0.946,347 -2,348 0.319,349 -1.039,350 -2,351 -3,352 -1.645,353 -7.5,354 -2,364 5.967,365 0.459,366 0.388,367 0.03,368 16.25,369 1.25,370 8,371 0.615,372 8.25,373 0.635,374 7.833,375 0.603,376 14.433,377 0.628,378 9.947,379 0.765,380 3.336,381 0.257,382 2.862,383 0.22,384 0.179,386 0.402,389 0.751,390 1.028,391 0.794,392 0.856,393 0.817,394 0.83,395 0.589,396 1.258,397 0.775,398 1.137,399 0.623,400 1.018,401 0.738,402 1.115,403 0.88,404 1.13,405 0.732,406 1.049,407 1.414,408 0.988,409 1.219,410 1.029,411 1.341,412 1.071,413 1.476,414 0.982,415 1.313,416 1.06,417 1.39,418 1.146,419 0.976,420 0.718,421 0.979,422 0.779,423 1.096,424 0.867,425 0.763,426 0.371,427 0.84,428 0.48,429 0.924,430 0.643,437 2.5,439 2,440 1.188,441 0.978,442 0.229,443 0.08,447 912,448 2956,449 1.992,450 43.5,452 5,454 3,455 2,456 1.492,457 1.814,458 2.401,459 1.463,462 38.293,463 1.665,464 3.534,465 3.915,466 4.263,467 4.35,468 4.35,469 1.577,470 3.239,471 3.68,472 2.35,473 183.327,474 6.126,475 1347.76,476 104.042,477 1.549,478 3.601,479 0.179,481 0.1,482 0.057,483 0.07,484 0.033,485 0.04,489 0.478,490 0.67,491 0.773,492 45.6,493 -0.005,494 0.206,495 -0.012,496 0.208,497 -0.143,498 0.114,499 0.059,500 -0.105,501 0.026,502 -0.076,503 -0.027,504 -0.041,505 0.184,506 -0.089,507 0.034,508 -0.158,509 0.189,510 -0.107,511 -0.213,512 -0.073,513 -0.218,514 -0.123,515 -0.122,516 -0.162,517 -0.288,518 -0.157,519 -0.281,520 -0.151,521 -0.211,522 -0.208,523 -0.061,524 -0.015,525 0.129,526 0.096,527 -0.085,528 0.148,529 0.019,530 0.251,531 0.324,532 0.373,533 -0.059,534 0.418,535 0.445,536 0.454,537 1.255,538 0.88,539 0.37,540 1.204,541 2.112,542 4.239,543 0.769,544 5.065,545 1.017,546 1.134,547 0.721,548 0.52,549 0.651,550 2.708,551 3.045,552 3.332,553 3.526,554 3.714,555 3.611,556 3.434,557 3.258,558 3.091,559 2.197,560 3.109,561 0.634,562 178.21,563 2.708,564 4.234,565 5.094,566 5.974,567 6.851,568 7.736,569 8.617,570 9.502,571 10.384,572 11.27,573 8.7,574 1,578 1,579 4,580 2,582 1,586 23,587 7,588 14,589 24,590 9,591 2,592 4,594 2,595 3,598 2,601 2,602 7,603 2,605 1,606 1,608 1,612 10,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,631 13,632 1,633 1,635 1,636 1,639 8.7,640 1,642 1,645 7.167,646 3.817,647 2.861,648 1.23,649 1.375,650 1.246,651 0.925,652 1.884,653 6.973,654 2.944,655 3.481,656 4.003,657 4.441,658 4.92,659 4.913,660 5.048,661 5.139,662 5.109,663 4.343,664 0.5,665 21,666 4.798,667 -0.003,668 2.111,669 8.179,670 8.828,671 -0.001,672 7.316,673 0.001,674 2.679,675 34.833,676 0.004,677 82.398,678 51.086,679 32.897,681 67.951,683 51.086,684 150.348,685 32.897,687 35.432,688 80.711,689 29.85,690 5.942,692 82.398,694 82.398,695 83.984,696 67.951,698 58.856,699 48.687,700 42.806,701 35.432,702 48.552,704 82.398,705 100.848,706 51.086,707 82.398,708 13.182,709 37.905,710 100.848,711 82.398,712 100.848,713 51.086,714 0.593,715 0.367,716 0.187,717 0.098,718 11,719 5,722 1,723 1.2,724 2.422,725 81.725,726 0.2,727 10,728 48.106,729 8.381,730 2.923,731 1.25,732 100.848,733 7.172,734 1.436,735 75.703,736 234.332,737 18,738 11.239,740 -0.446,741 23.393,742 26.076,743 0.368,744 0.781,745 0.865,746 0.942,747 0.962,748 0.962,749 4.182,750 -0.799,751 5.106,752 -0.304,753 3.714,754 4.159,755 2.543,756 5.953,757 3.683,758 5.376,759 -1,760 6.703,761 -1.916,762 3.434,763 3.951,764 2.078,765 6.94,766 3.372,767 6.68,768 -1.299,769 8.405,770 -2.433,771 5.342,772 6.247,773 3.726,774 10.066,775 5.27,776 8.019,777 -1.522,778 10.164,779 -3.288,780 5.861,781 6.819,782 3.934,783 11.834,784 5.755,785 9.391,786 -1.737,787 11.958,788 -4.485,789 7.288,790 8.635,791 5.161,792 14.502,793 7.168,794 10.786,795 -2,796 13.775,797 -5.294,798 8.161,799 9.572,800 5.695,801 16.593,802 8.007,803 12.198,804 -2,805 15.607,806 -5.722,807 9.41,808 11.18,809 6.718,810 19.093,811 9.237,812 3.165,814 17.452,815 -7.5,816 10.439,817 12.305,818 7.405,819 21.331,820 10.235,821 2.424,822 10.688,823 19.306,825 11.623,826 13.808,827 8.33,828 23.76,829 11.396,830 2.027,831 7.667,832 21.168,833 3.919,834 12.72,835 15.034,836 9.089,837 26.066,838 12.463,839 1.427,840 6.002,841 23.035,842 3.043,843 13.881,844 16.479,845 9.966,846 28.463,847 13.599,848 1.073,849 3.056,850 24.908,851 2.255,852 15.008,853 17.763,854 10.76,855 30.802,856 14.699,857 0.367,858 2.703,859 26.785,860 2.053,861 16.161,862 19.175,863 11.613,864 33.185,865 15.827,866 -0.125,867 0.825,868 28.665,869 1.41,870 17.302,871 20.493,872 12.425,873 35.539,874 16.94,875 981,876 1817,877 8.959,878 14.966,879 21.536,880 23.792,881 22.382,882 21.054,883 20.965,884 26.312,885 7.256,886 61.884,887 20.689,888 5.352,889 6.326,890 6.38,891 5.181,892 5.165,893 6.919,894 3.935,895 18.188,896 5.089,897 6.352,898 1.538,899 1.699,900 1.599,901 1.504,902 1.498,903 1.879,904 0.518,905 4.42,906 1.478,907 3.992,908 4.023,909 3.938,910 3.902,911 7.429,912 3.905,913 3.558,914 3.605,915 3.474,916 3.389,917 6.465,918 3.401,919 3.131,920 3.187,921 3.022,922 2.874,923 4.988,924 2.896,925 2.887,926 2.983,927 2.744,928 2.677,929 4.693,930 2.684,931 2.725,932 2.778,933 2.577,934 2.472,935 3.758,936 2.498,937 2.515,938 2.597,939 2.298,940 2.067,941 3.645,942 2.078,943 2.291,944 2.366,945 2.022,946 1.759,947 3.018,948 1.851,949 1.697,950 1.869,951 1.221,952 1.256,953 2.705,954 1.217,955 0.315,956 0.309,957 0.478,958 0.296,959 0.226,960 4.407,961 0.28,962 4.326,963 0.164,964 6.699,965 0.763,966 4.143,967 0.221,968 3.165,969 3.919,970 2.291,971 10.688,972 3.089,973 1.953,974 1.926,975 2.061,976 2.07,977 1.262,978 2.066,979 1.51,980 1.464,981 1.704,982 1.711,983 0.839,984 1.711,985 1.015,986 0.967,987 1.231,988 1.353,989 0.275,990 1.295,991 0.839,992 0.762,993 1.142,994 1.153,995 0.143,996 1.176,997 0.669,998 0.607,999 0.961,1000 0.935,1002 0.962,1003 0.405,1004 0.271,1005 0.791,1006 0.838,1008 0.795,1009 0.118,1010 0.05,1011 0.605,1012 0.617,1014 0.632,1017 0.315,1018 0.19,1020 0.252,1021 3.367,1022 4.691,1023 6.244,1024 7.901,1025 9.61,1029 5.532,1030 9.404,1031 0.492,1033 -0.625,1034 0.628,1036 14.58,1037 38.293,1038 81.287,1039 90.042,1040 98.042,1041 100.042,1042 100.042,1043 22.321,1044 5.598,1045 66.56,1046 66.56,1047 12,1048 11.802,1049 3,1050 2.322,1051 18.983,1052 26,1053 16,1054 0.429,1055 92.186,1056 157.66,1057 216.694,1058 1384,1060 9.422,1061 0.725,1062 0.536,1063 9.422,1064 6.974,1065 6.198,1066 0.443,1067 0.29,1068 4.003,1069 5.941,1070 3.941,1071 3.253,1072 6.198,1073 4.062,1074 5.64,1075 0.282,1076 0.154,1077 5.64,1078 3.089,1079 5.045,1080 0.187,1081 0.081,1082 5.045,1083 2.186,1084 3.821,1085 0.116,1086 0.045,1087 3.821,1088 1.49,1089 2.954,1090 0.074,1091 0.025,1092 2.954,1093 0.999,1094 0.603,1095 39.256,1096 0.334,1097 12.61,1098 1.391,1099 68,1100 216.843,1101 75.76,1102 209.515,1103 277.8,1104 192,1105 81,1106 203.902,1107 90.007,1108 203.196,1109 296.13,1110 191,1111 6.58}
{0 CHEMBL2047852,1 1.665,2 5,3 -0.051,4 0.003,5 47.394,6 7.748,7 0.429,8 3.272,9 3.39,10 2.85,11 2.768,12 4.513,13 2.77,14 3.746,15 3.892,16 3.216,17 3.162,18 4.916,19 3.145,20 4.069,21 4.254,22 3.347,23 3.265,24 5.483,25 3.239,26 4.06,27 4.272,28 3.032,29 3.066,30 5.383,31 3.019,32 3.773,33 4.009,34 2.469,35 2.694,36 5.026,37 2.591,38 3.318,39 3.642,40 1.566,41 2.062,42 4.357,43 1.853,44 2.356,45 2.72,46 0.351,47 1.113,48 3.091,49 0.846,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.113,57 0.344,58 4.654,59 1.926,60 12.988,61 2.454,62 0.129,63 0.536,64 7.8,65 3.266,66 15.991,67 4.337,68 0.334,69 0.645,70 12.333,71 4.187,72 59.594,73 5.727,74 0.377,75 0.555,76 13.516,77 3.772,78 56.468,79 5.126,80 0.283,81 0.384,82 10.633,83 2.951,84 43.469,85 4.064,86 0.178,87 0.216,88 7.54,89 1.88,90 29.643,91 2.989,92 0.071,93 0.07,94 2.965,95 0.686,96 12.244,97 1.171,98 0.011,99 0.011,100 0.63,101 0.146,102 1.802,103 0.275,104 10,105 20,106 0.346,107 0.735,108 0.814,109 0.887,110 0.905,111 0.905,112 2.672,113 0.871,114 -1.95,115 -2.01,116 -2,117 39.1,119 1,123 1,128 4,129 1,130 1,135 1,137 5,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 4,153 1,155 3,158 1,159 4,160 1,161 1,163 1,165 2,168 3,171 2,173 1,177 1,179 1,194 102,195 8.552,196 8.552,197 8.552,198 8.552,199 8.552,200 7.72,201 9.276,202 4.924,203 8.635,204 6.853,205 6.853,206 6.853,207 6.853,208 6.853,209 5.525,210 8.394,211 2.297,212 6.958,213 2.859,214 0.989,215 0.609,216 0.261,217 0.174,218 0.174,219 3.303,221 135,222 1.581,223 51.529,224 44.341,226 0.615,227 18.35,228 0.67,229 0.83,230 0.8,232 0.76,233 29,234 65,235 4.407,236 4.326,237 6.699,238 4.143,239 3.165,240 3.919,241 2.291,242 10.688,243 3.089,244 3.763,245 3.326,246 5.83,247 3.427,248 2.424,249 3.043,250 1.257,251 7.667,252 2.425,253 3.152,254 2.854,255 5.181,256 2.995,257 2.027,258 2.255,259 0.08,260 6.002,261 1.958,262 2.889,263 2.006,264 3.872,265 2.427,266 1.427,267 2.053,269 3.056,270 1.427,271 2.444,272 1.476,273 3.653,274 2.067,275 1.073,276 1.41,278 2.703,279 1.063,280 1.827,281 1.405,282 3.099,283 1.425,284 0.367,285 0.476,286 0.825,287 0.383,288 1.083,289 0.437,290 2.631,291 0.855,292 -0.125,293 -0.143,294 -0.304,295 -0.122,296 0.604,297 -0.083,298 2,299 0.187,300 -0.799,301 -0.976,302 -1.916,303 -0.785,304 0.313,305 -0.528,306 1.724,307 -0.017,308 -1,309 -1.292,310 -2.433,311 -0.982,313 -0.872,314 1.525,315 -0.253,316 -1.299,317 -1.619,318 -3.288,319 -1.35,320 -0.448,321 -1.022,322 1.231,323 -0.558,324 -1.522,325 -1.798,326 -4.485,327 -1.478,328 -0.5,329 -1.496,330 1.209,331 -0.76,332 -1.737,333 -2.143,334 -0.67,335 -5.294,336 -1.681,337 -0.588,338 -1.668,339 1.027,340 -1,341 -2,342 -2.185,343 -1.313,344 -5.722,345 -1.946,346 -0.946,347 -2,348 0.319,349 -1.039,350 -2,351 -3,352 -1.645,353 -7.5,354 -2,364 5.967,365 0.459,366 0.388,367 0.03,368 16.25,369 1.25,370 8,371 0.615,372 8.25,373 0.635,374 7.833,375 0.603,376 14.433,377 0.628,378 9.947,379 0.765,380 3.336,381 0.257,382 2.862,383 0.22,384 0.179,386 0.402,389 0.751,390 1.028,391 0.794,392 0.856,393 0.817,394 0.83,395 0.589,396 1.258,397 0.775,398 1.137,399 0.623,400 1.018,401 0.738,402 1.115,403 0.88,404 1.13,405 0.732,406 1.049,407 1.414,408 0.988,409 1.219,410 1.029,411 1.341,412 1.071,413 1.476,414 0.982,415 1.313,416 1.06,417 1.39,418 1.146,419 0.976,420 0.718,421 0.979,422 0.779,423 1.096,424 0.867,425 0.763,426 0.371,427 0.84,428 0.48,429 0.924,430 0.643,437 2.5,439 2,440 1.188,441 0.978,442 0.229,443 0.08,447 912,448 2956,449 1.992,450 43.5,452 5,454 3,455 2,456 1.492,457 1.814,458 2.401,459 1.463,462 38.293,463 1.665,464 3.534,465 3.915,466 4.263,467 4.35,468 4.35,469 1.577,470 3.239,471 3.68,472 2.35,473 183.327,474 6.126,475 1347.76,476 104.042,477 1.549,478 3.601,479 0.179,481 0.1,482 0.057,483 0.07,484 0.033,485 0.04,489 0.478,490 0.67,491 0.773,492 45.6,493 -0.005,494 0.206,495 -0.012,496 0.208,497 -0.143,498 0.114,499 0.059,500 -0.105,501 0.026,502 -0.076,503 -0.027,504 -0.041,505 0.184,506 -0.089,507 0.034,508 -0.158,509 0.189,510 -0.107,511 -0.213,512 -0.073,513 -0.218,514 -0.123,515 -0.122,516 -0.162,517 -0.288,518 -0.157,519 -0.281,520 -0.151,521 -0.211,522 -0.208,523 -0.061,524 -0.015,525 0.129,526 0.096,527 -0.085,528 0.148,529 0.019,530 0.251,531 0.324,532 0.373,533 -0.059,534 0.418,535 0.445,536 0.454,537 1.255,538 0.88,539 0.37,540 1.204,541 2.112,542 4.239,543 0.769,544 5.065,545 1.017,546 1.134,547 0.721,548 0.52,549 0.651,550 2.708,551 3.045,552 3.332,553 3.526,554 3.714,555 3.611,556 3.434,557 3.258,558 3.091,559 2.197,560 3.109,561 0.634,562 178.21,563 2.708,564 4.234,565 5.094,566 5.974,567 6.851,568 7.736,569 8.617,570 9.502,571 10.384,572 11.27,573 8.7,574 1,578 1,579 4,580 2,582 1,586 23,587 7,588 14,589 24,590 9,591 2,592 4,594 2,595 3,598 2,601 2,602 7,603 2,605 1,606 1,608 1,612 10,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,631 13,632 1,633 1,635 1,636 1,639 8.7,640 1,642 1,645 7.167,646 3.817,647 2.861,648 1.23,649 1.375,650 1.246,651 0.925,652 1.884,653 6.973,654 2.944,655 3.481,656 4.003,657 4.441,658 4.92,659 4.913,660 5.048,661 5.139,662 5.109,663 4.343,664 0.5,665 21,666 4.798,667 -0.003,668 2.111,669 8.179,670 8.828,671 -0.001,672 7.316,673 0.001,674 2.679,675 34.833,676 0.004,677 82.398,678 51.086,679 32.897,681 67.951,683 51.086,684 150.348,685 32.897,687 35.432,688 80.711,689 29.85,690 5.942,692 82.398,694 82.398,695 83.984,696 67.951,698 58.856,699 48.687,700 42.806,701 35.432,702 48.552,704 82.398,705 100.848,706 51.086,707 82.398,708 13.182,709 37.905,710 100.848,711 82.398,712 100.848,713 51.086,714 0.593,715 0.367,716 0.187,717 0.098,718 11,719 5,722 1,723 1.2,724 2.422,725 81.725,726 0.2,727 10,728 48.106,729 8.381,730 2.923,731 1.25,732 100.848,733 7.172,734 1.436,735 75.703,736 234.332,737 18,738 11.239,740 -0.446,741 23.393,742 26.076,743 0.368,744 0.781,745 0.865,746 0.942,747 0.962,748 0.962,749 4.182,750 -0.799,751 5.106,752 -0.304,753 3.714,754 4.159,755 2.543,756 5.953,757 3.683,758 5.376,759 -1,760 6.703,761 -1.916,762 3.434,763 3.951,764 2.078,765 6.94,766 3.372,767 6.68,768 -1.299,769 8.405,770 -2.433,771 5.342,772 6.247,773 3.726,774 10.066,775 5.27,776 8.019,777 -1.522,778 10.164,779 -3.288,780 5.861,781 6.819,782 3.934,783 11.834,784 5.755,785 9.391,786 -1.737,787 11.958,788 -4.485,789 7.288,790 8.635,791 5.161,792 14.502,793 7.168,794 10.786,795 -2,796 13.775,797 -5.294,798 8.161,799 9.572,800 5.695,801 16.593,802 8.007,803 12.198,804 -2,805 15.607,806 -5.722,807 9.41,808 11.18,809 6.718,810 19.093,811 9.237,812 3.165,814 17.452,815 -7.5,816 10.439,817 12.305,818 7.405,819 21.331,820 10.235,821 2.424,822 10.688,823 19.306,825 11.623,826 13.808,827 8.33,828 23.76,829 11.396,830 2.027,831 7.667,832 21.168,833 3.919,834 12.72,835 15.034,836 9.089,837 26.066,838 12.463,839 1.427,840 6.002,841 23.035,842 3.043,843 13.881,844 16.479,845 9.966,846 28.463,847 13.599,848 1.073,849 3.056,850 24.908,851 2.255,852 15.008,853 17.763,854 10.76,855 30.802,856 14.699,857 0.367,858 2.703,859 26.785,860 2.053,861 16.161,862 19.175,863 11.613,864 33.185,865 15.827,866 -0.125,867 0.825,868 28.665,869 1.41,870 17.302,871 20.493,872 12.425,873 35.539,874 16.94,875 981,876 1817,877 8.959,878 14.966,879 21.536,880 23.792,881 22.382,882 21.054,883 20.965,884 26.312,885 7.256,886 61.884,887 20.689,888 5.352,889 6.326,890 6.38,891 5.181,892 5.165,893 6.919,894 3.935,895 18.188,896 5.089,897 6.352,898 1.538,899 1.699,900 1.599,901 1.504,902 1.498,903 1.879,904 0.518,905 4.42,906 1.478,907 3.992,908 4.023,909 3.938,910 3.902,911 7.429,912 3.905,913 3.558,914 3.605,915 3.474,916 3.389,917 6.465,918 3.401,919 3.131,920 3.187,921 3.022,922 2.874,923 4.988,924 2.896,925 2.887,926 2.983,927 2.744,928 2.677,929 4.693,930 2.684,931 2.725,932 2.778,933 2.577,934 2.472,935 3.758,936 2.498,937 2.515,938 2.597,939 2.298,940 2.067,941 3.645,942 2.078,943 2.291,944 2.366,945 2.022,946 1.759,947 3.018,948 1.851,949 1.697,950 1.869,951 1.221,952 1.256,953 2.705,954 1.217,955 0.315,956 0.309,957 0.478,958 0.296,959 0.226,960 4.407,961 0.28,962 4.326,963 0.164,964 6.699,965 0.763,966 4.143,967 0.221,968 3.165,969 3.919,970 2.291,971 10.688,972 3.089,973 1.953,974 1.926,975 2.061,976 2.07,977 1.262,978 2.066,979 1.51,980 1.464,981 1.704,982 1.711,983 0.839,984 1.711,985 1.015,986 0.967,987 1.231,988 1.353,989 0.275,990 1.295,991 0.839,992 0.762,993 1.142,994 1.153,995 0.143,996 1.176,997 0.669,998 0.607,999 0.961,1000 0.935,1002 0.962,1003 0.405,1004 0.271,1005 0.791,1006 0.838,1008 0.795,1009 0.118,1010 0.05,1011 0.605,1012 0.617,1014 0.632,1017 0.315,1018 0.19,1020 0.252,1021 3.367,1022 4.691,1023 6.244,1024 7.901,1025 9.61,1029 5.532,1030 9.404,1031 0.492,1033 -0.625,1034 0.628,1036 14.58,1037 38.293,1038 81.287,1039 90.042,1040 98.042,1041 100.042,1042 100.042,1043 22.321,1044 5.598,1045 66.56,1046 66.56,1047 12,1048 11.802,1049 3,1050 2.322,1051 18.983,1052 26,1053 16,1054 0.429,1055 92.186,1056 157.66,1057 216.694,1058 1384,1060 9.422,1061 0.725,1062 0.536,1063 9.422,1064 6.974,1065 6.198,1066 0.443,1067 0.29,1068 4.003,1069 5.941,1070 3.941,1071 3.253,1072 6.198,1073 4.062,1074 5.64,1075 0.282,1076 0.154,1077 5.64,1078 3.089,1079 5.045,1080 0.187,1081 0.081,1082 5.045,1083 2.186,1084 3.821,1085 0.116,1086 0.045,1087 3.821,1088 1.49,1089 2.954,1090 0.074,1091 0.025,1092 2.954,1093 0.999,1094 0.603,1095 39.256,1096 0.334,1097 12.61,1098 1.391,1099 68,1100 216.843,1101 75.76,1102 209.515,1103 277.8,1104 192,1105 81,1106 203.902,1107 90.007,1108 203.196,1109 296.13,1110 191,1111 5.932}
{0 CHEMBL2047853,1 1.614,2 5.143,3 0.357,4 0.128,5 52.145,6 7.394,7 0.4,8 3.377,9 3.498,10 2.931,11 2.854,12 4.534,13 2.849,14 3.888,15 4.052,16 3.272,17 3.218,18 4.968,19 3.201,20 4.125,21 4.313,22 3.419,23 3.337,24 5.394,25 3.317,26 4.157,27 4.357,28 3.227,29 3.254,30 5.351,31 3.21,32 4.027,33 4.233,34 2.826,35 3.066,36 5.192,37 2.967,38 3.808,39 4.107,40 1.982,41 2.702,42 4.771,43 2.456,44 3.381,45 3.802,46 0.63,47 1.95,48 3.85,49 1.518,50 1.693,51 2.115,52 0.035,53 0.545,54 1.792,55 0.298,56 0.088,57 0.379,58 5.539,59 2.249,60 8.268,61 3.001,62 0.179,63 0.579,64 10.233,65 3.641,66 17.283,67 4.984,68 0.336,69 0.695,70 13.555,71 4.241,72 40.669,73 6.003,74 0.32,75 0.641,76 14.661,77 4.384,78 37.178,79 6.042,80 0.3,81 0.53,82 13.193,83 4.026,84 38.819,85 5.442,86 0.195,87 0.404,88 11.127,89 3.263,90 31.186,91 5.085,92 0.145,93 0.2,94 8.398,95 2.203,96 20.905,97 3.812,98 0.024,99 0.027,100 1.413,101 0.345,102 3.058,103 0.634,104 11,105 21,106 0.326,107 0.689,108 0.803,109 0.865,110 0.881,111 0.881,112 2.737,113 0.891,114 -2.25,115 -2.29,116 -2.26,117 38.5,119 1,121 1,123 1,128 4,129 1,130 1,132 1,137 5,139 1,140 2,142 1,143 5,144 1,145 1,146 6,148 2,149 2,150 1,151 4,153 1,155 6,156 1,157 1,159 1,161 1,163 1,165 3,168 2,171 2,173 1,177 1,179 1,194 136,195 9.422,196 9.422,197 9.422,198 9.422,199 9.422,200 8.59,201 9.493,202 5.459,203 9.51,204 7.3,205 7.3,206 7.3,207 7.3,208 7.3,209 5.986,210 8.516,211 2.452,212 7.453,213 3.086,214 1.289,215 0.721,216 0.414,217 0.337,218 0.337,219 3.375,221 148,222 1.871,223 57.312,224 49.352,226 0.612,227 15.574,228 0.83,229 0.83,230 0.8,231 0.5,232 0.85,233 31,234 72,235 4.421,236 4.465,237 6.761,238 4.162,239 3.187,240 3.926,241 2.599,242 10.996,243 3.103,244 3.769,245 3.419,246 5.835,247 3.429,248 2.426,249 3.055,250 1.643,251 7.707,252 2.427,253 3.193,254 2.874,255 5.272,256 3.056,257 2.092,258 2.287,259 0.187,260 6.293,261 2.012,262 2.891,263 2.042,264 3.928,265 2.432,266 1.431,267 2.055,269 3.094,270 1.431,271 2.485,272 1.499,273 3.664,274 2.108,275 1.125,276 1.474,278 2.786,279 1.102,280 2.065,281 1.443,282 3.327,283 1.731,284 0.747,285 0.874,286 1.447,287 0.718,288 1.268,289 0.724,290 2.631,291 0.971,296 0.886,297 0.293,298 2.425,299 0.64,300 -0.298,301 -0.335,302 -0.613,303 -0.279,304 0.544,305 -0.136,306 2,307 0.099,308 -0.89,309 -1.099,310 -2.088,311 -0.871,312 0.312,313 -0.536,314 1.694,315 -0.017,316 -1,317 -1.331,318 -2.433,319 -0.983,320 -0.121,321 -0.876,322 1.396,323 -0.341,324 -1.369,325 -1.725,326 -3.604,327 -1.419,328 -0.5,329 -1.026,330 1.223,331 -0.732,332 -1.69,333 -1.848,335 -4.852,336 -1.602,337 -0.588,338 -1.497,339 1.028,340 -0.801,341 -1.761,342 -2.144,343 -0.726,344 -5.391,345 -1.692,346 -0.679,347 -1.668,348 0.497,349 -1,350 -2,351 -2.189,352 -1.435,353 -5.844,354 -1.946,355 -0.947,356 -2,357 0.318,358 -1.039,359 -2,360 -3,361 -2.268,362 -7.5,363 -2,364 6.467,365 0.462,366 0.35,367 0.025,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 8.964,375 0.64,376 15.733,377 0.605,378 10.767,379 0.769,380 3.564,381 0.255,382 3.173,383 0.227,384 0.191,386 0.371,389 0.684,390 1.203,391 0.788,392 1.066,393 0.713,394 0.957,395 0.942,396 1.195,397 0.827,398 0.998,399 0.717,400 0.91,401 0.864,402 1.042,403 0.903,404 1.01,405 0.862,406 0.955,407 1.374,408 1.033,409 1.141,410 1.061,411 1.326,412 1.053,413 1.603,414 1.108,415 1.395,416 1.161,417 1.488,418 1.245,419 0.817,420 1.012,421 1.244,422 1.175,423 1.101,424 1.277,425 0.288,426 0.351,427 0.481,428 0.439,429 0.478,430 0.494,437 2.5,439 2,440 1.313,441 1.098,442 0.319,443 0.12,447 1101,448 3261,449 1.993,450 46.2,452 8,454 2,455 2,456 1.518,457 1.826,458 2.435,459 0.547,462 41.973,463 1.614,464 3.412,465 3.979,466 4.287,467 4.364,468 4.364,469 1.531,470 3.093,471 3.784,472 2.412,473 219.458,474 6.349,475 1720.67,476 122.211,477 1.531,478 3.714,479 0.167,481 0.095,482 0.057,483 0.061,484 0.029,485 0.04,489 0.449,490 0.83,491 1.02,492 50.959,493 0.075,494 0.048,495 0.042,496 0.03,497 -0.1,498 0.03,499 -0.021,500 -0.09,501 0.072,502 0.042,503 -0.054,504 0.065,505 0.151,506 0.047,507 0.036,508 -0.048,509 0.15,510 -0.026,511 -0.165,512 -0.056,513 -0.161,514 -0.117,515 -0.089,516 -0.132,517 -0.335,518 -0.208,519 -0.408,520 -0.207,521 -0.204,522 -0.314,523 -0.093,524 -0.173,525 -0.273,526 -0.268,527 -0.147,528 -0.301,529 0.225,530 0.224,531 0.593,532 0.417,533 0.141,534 0.56,535 0.406,536 0.458,537 1.13,538 0.826,539 0.369,540 1.089,541 1.855,542 4.595,543 0.714,544 6,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.091,552 3.401,553 3.638,554 3.829,555 3.714,556 3.611,557 3.434,558 3.219,559 2.485,560 3.277,561 0.619,562 192.24,563 2.773,564 4.29,565 5.153,566 6.038,567 6.921,568 7.81,569 8.697,570 9.587,571 10.475,572 11.365,573 7.7,574 1,578 1,579 4,580 2,582 1,586 26,587 7,588 15,589 27,590 10,591 2,592 4,594 2,595 3,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 4,614 2,615 4,617 2,619 2,620 2,621 1,625 1,627 1,628 1,631 14,633 1,634 1,635 1,636 1,639 7.7,642 1,643 1,645 7.667,646 4.783,647 3.194,648 1.39,649 1.364,650 1.238,651 0.943,652 2.334,653 7.1,654 2.996,655 3.512,656 4.039,657 4.509,658 4.977,659 4.978,660 5.147,661 5.264,662 5.192,663 4.55,664 0.5,665 23,666 5.16,667 0.002,668 2.18,669 7.952,670 9.661,671 0.001,672 7.783,673 -0.001,674 2.452,675 34.333,676 0.004,677 117.711,678 61.97,679 38.636,681 36.364,683 61.97,684 154.075,685 38.636,686 10.883,687 41.17,688 37.905,689 41.068,690 5.942,692 117.711,694 117.711,695 100.605,696 36.364,698 94.169,699 48.687,700 11.219,701 41.17,702 59.435,704 117.711,705 75,706 61.97,707 117.711,708 13.182,709 54.527,710 69.261,711 117.711,712 75,713 61.97,714 0.578,715 0.369,716 0.206,717 0.109,718 11,719 5,720 0.037,721 1,722 1,723 1.2,724 2.512,725 90.783,726 0.2,727 10,728 53.303,729 9.339,730 3.498,731 1.472,732 75,733 7.598,734 1.836,735 32.897,736 254.68,737 19,738 11.595,740 -0.189,741 26.276,742 29.491,743 0.343,744 0.726,745 0.847,746 0.912,747 0.928,748 0.928,749 4.227,750 -0.298,751 5.153,753 3.761,754 4.19,755 2.902,756 6.009,757 3.723,758 5.408,759 -0.89,760 6.749,761 -0.613,762 3.434,763 3.951,764 2.078,765 7.029,766 3.372,767 6.709,768 -1,769 8.45,770 -2.088,771 5.389,772 6.266,773 4.441,774 10.159,775 5.306,776 8.045,777 -1.369,778 10.212,779 -2.433,780 5.889,781 6.83,782 4.177,783 11.981,784 5.775,785 9.417,786 -1.69,787 12.011,788 -3.604,789 7.338,790 8.65,791 6.16,792 14.648,793 7.203,794 10.812,795 -1.761,796 13.834,797 -4.852,798 8.208,799 9.588,800 6.239,801 16.795,802 8.04,803 12.226,804 -2,805 15.674,806 -5.391,807 9.467,808 11.196,809 7.955,810 19.301,811 9.277,812 3.187,813 -2,814 17.527,815 -5.844,816 10.501,817 12.323,818 8.263,819 21.588,820 10.277,821 2.426,822 10.996,823 19.389,824 -7.5,825 11.691,826 13.825,827 9.788,828 24.031,829 11.443,830 2.092,831 7.707,832 21.259,833 3.926,834 12.795,835 15.054,836 10.258,837 26.379,838 12.515,839 1.431,840 6.293,841 23.136,842 3.055,843 13.962,844 16.499,845 11.642,846 28.796,847 13.656,848 1.125,849 3.094,850 25.018,851 2.287,852 15.096,853 17.786,854 12.23,855 31.171,856 14.76,857 0.747,858 2.786,859 26.904,860 2.055,861 16.256,862 19.198,863 13.509,864 33.578,865 15.893,867 1.447,868 28.793,869 1.474,870 17.404,871 20.518,872 14.186,873 35.965,874 17.011,875 1184,876 2094,877 9.652,878 16.727,879 22.452,880 24.514,881 23.974,882 22.077,883 22.015,884 27.34,885 8.858,886 64.648,887 21.585,888 5.367,889 6.465,890 6.443,891 5.201,892 5.187,893 6.926,894 4.866,895 18.496,896 5.103,897 6.861,898 1.497,899 1.634,900 1.598,901 1.472,902 1.468,903 1.823,904 0.591,905 4.31,906 1.439,907 3.995,908 4.025,909 3.942,910 3.904,911 7.427,912 3.906,913 3.562,914 3.608,915 3.479,916 3.391,917 4.996,918 3.404,919 3.299,920 3.368,921 3.138,922 2.983,923 4.77,924 3.006,925 2.987,926 3.049,927 2.829,928 2.795,929 4.538,930 2.79,931 2.856,932 2.968,933 2.685,934 2.663,935 3.755,936 2.661,937 2.72,938 2.77,939 2.57,940 2.432,941 3.649,942 2.458,943 2.421,944 2.539,945 2.134,946 2.064,947 3.136,948 2.064,949 1.892,950 1.984,951 1.693,952 1.39,953 2.971,954 1.439,955 0.295,956 0.298,957 0.451,958 0.277,959 0.212,960 4.421,961 0.262,962 4.465,963 0.173,964 6.761,965 0.733,966 4.162,967 0.207,968 3.187,969 3.926,970 2.599,971 10.996,972 3.103,973 1.954,974 1.927,975 2.062,976 2.072,977 1.265,978 2.067,979 1.512,980 1.466,981 1.706,982 1.714,983 0.839,984 1.714,985 1.213,986 1.137,987 1.581,988 1.563,989 0.58,990 1.564,991 0.959,992 0.899,993 1.218,994 1.197,995 0.275,996 1.202,997 0.821,998 0.744,999 1.123,1000 1.145,1001 0.143,1002 1.151,1003 0.635,1004 0.568,1005 0.904,1006 0.929,1008 0.938,1009 0.4,1010 0.263,1011 0.791,1012 0.726,1014 0.753,1017 0.385,1018 0.265,1020 0.31,1021 3.434,1022 4.745,1023 6.293,1024 7.953,1025 9.667,1026 1.465,1029 5.688,1031 0.578,1032 5.004,1033 -0.496,1034 1.253,1036 16.106,1037 41.973,1038 88.702,1039 103.457,1040 111.457,1041 113.457,1042 113.457,1043 21.055,1044 5.737,1045 55.56,1046 55.56,1047 12,1048 11.894,1049 3,1050 2.322,1051 21.061,1052 29,1053 22,1054 0.418,1055 101.779,1056 174.96,1057 240.1,1058 1653,1060 10.129,1061 0.724,1062 0.567,1063 10.129,1064 7.935,1065 6.736,1066 0.449,1067 0.297,1068 4.367,1069 6.394,1070 4.252,1071 3.542,1072 6.736,1073 4.453,1074 5.853,1075 0.279,1076 0.155,1077 5.853,1078 3.255,1079 5.237,1080 0.181,1081 0.081,1082 5.237,1083 2.35,1084 4.271,1085 0.115,1086 0.045,1087 4.271,1088 1.663,1089 3.388,1090 0.075,1091 0.026,1092 3.388,1093 1.149,1094 0.59,1095 42.937,1096 0.322,1097 13.586,1098 1.355,1099 72,1100 232.428,1101 80.867,1102 218.59,1103 294.94,1104 204,1105 86,1106 216.974,1107 96.226,1108 215.898,1109 315.34,1110 202,1111 5}
{0 CHEMBL2047854,1 1.614,2 5.071,3 0.154,4 0.024,5 52.032,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.582,13 2.862,14 3.872,15 4.031,16 3.336,17 3.29,18 5.005,19 3.268,20 4.217,21 4.389,22 3.488,23 3.447,24 5.621,25 3.41,26 4.365,27 4.617,28 3.209,29 3.299,30 5.602,31 3.229,32 3.973,33 4.187,34 2.684,35 2.96,36 5.231,37 2.854,38 3.657,39 3.979,40 1.857,41 2.494,42 4.604,43 2.251,44 2.931,45 3.307,46 0.584,47 1.666,48 3.555,49 1.317,50 1.693,51 2.115,52 0.035,53 0.545,54 1.792,55 0.298,56 0.105,57 0.382,58 5.588,59 2.265,60 12.377,61 3.008,62 0.115,63 0.608,64 9.591,65 3.841,66 16.923,67 5.307,68 0.298,69 0.778,70 14.338,71 4.888,72 58.381,73 6.847,74 0.471,75 0.719,76 19.516,77 5.061,78 74.526,79 7.398,80 0.307,81 0.483,82 12.718,83 3.709,84 52.083,85 5.022,86 0.178,87 0.322,88 9.948,89 2.869,90 31.62,91 4.495,92 0.089,93 0.135,94 5.007,95 1.375,96 15.422,97 2.291,98 0.024,99 0.027,100 1.413,101 0.345,102 3.828,103 0.634,104 17,105 23,106 0.326,107 0.719,108 0.803,109 0.865,110 0.881,111 0.881,112 2.738,113 0.885,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,119 1,124 1,128 4,129 1,130 1,135 1,137 5,139 1,140 2,142 2,143 6,144 2,146 6,148 2,149 3,150 3,151 5,153 1,155 3,158 1,159 5,160 1,161 2,163 1,165 2,168 3,169 2,171 2,173 1,177 1,178 1,179 1,194 108,195 8.869,196 8.869,197 8.869,198 8.869,199 8.869,200 8.051,201 10.238,202 4.959,203 8.959,204 7.344,205 7.344,206 7.344,207 7.344,208 7.344,209 6.045,210 10.825,211 2.314,212 7.46,213 3.086,214 1.139,215 0.721,216 0.414,217 0.337,218 0.337,219 3.366,221 146,222 2.236,223 57.448,224 49.428,226 0.663,227 19.81,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 71,235 4.609,236 4.399,237 7.397,238 4.463,239 3.479,240 3.985,241 2.291,242 12.806,243 3.416,244 4.045,245 3.618,246 6.363,247 3.739,248 2.762,249 3.4,250 1.257,251 9.515,252 2.7,253 3.367,254 2.888,255 5.53,256 3.149,257 2.167,258 2.475,259 0.08,260 6.753,261 2.118,262 2.892,263 2.429,264 4.156,265 2.436,266 1.436,267 2.059,269 3.261,270 1.435,271 2.647,272 1.559,273 3.776,274 2.194,275 1.186,276 1.652,278 3.001,279 1.19,280 1.895,281 1.405,282 3.452,283 1.502,284 0.446,285 0.582,286 1.034,287 0.466,288 1.156,289 0.441,290 2.975,291 0.948,292 -0.044,293 -0.05,294 -0.118,295 -0.044,296 0.607,297 -0.031,298 2.328,299 0.198,300 -0.791,301 -0.974,302 -1.954,303 -0.781,304 0.341,305 -0.527,306 2,308 -1,309 -1,310 -2.772,311 -0.944,313 -0.766,314 2,315 -0.054,316 -1,317 -1.32,318 -3,319 -1,321 -1,322 1.792,323 -0.26,324 -1.31,325 -1.637,326 -3.415,327 -1.354,328 -0.464,329 -1.049,330 1.521,331 -0.593,332 -1.57,333 -1.839,335 -5.065,336 -1.557,337 -0.5,338 -1.528,339 1.24,340 -0.783,341 -1.76,342 -2.146,343 -0.67,344 -5.821,345 -1.7,346 -0.648,347 -1.678,348 1.149,349 -1,350 -2,351 -2.185,352 -1.313,353 -6.053,354 -1.947,355 -0.946,356 -2,357 0.319,358 -1.039,359 -2,360 -3,361 -1.645,362 -8.173,363 -2,364 6.467,365 0.462,366 0.564,367 0.04,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.986,375 0.713,376 15.733,377 0.605,378 10.769,379 0.769,380 3.303,381 0.236,382 3.219,383 0.23,384 0.242,385 0.077,386 0.294,389 0.743,390 1.071,391 0.831,392 0.922,393 0.832,394 0.893,395 0.545,396 1.234,397 0.667,398 1.044,399 0.576,400 0.904,401 0.766,402 1.325,403 1.017,404 1.328,405 0.766,406 1.231,407 1.419,408 0.791,409 1.08,410 0.805,411 1.358,412 0.857,413 1.712,414 1.04,415 1.459,416 1.133,417 1.599,418 1.245,419 0.766,420 0.829,421 0.973,422 0.934,423 0.874,424 0.993,425 0.47,426 0.573,427 0.785,428 0.717,429 0.581,430 0.805,437 4,439 2.667,440 1.625,441 1.249,442 0.313,443 0.12,447 1069,448 3233,449 1.936,450 46.2,452 4,454 3,455 5,456 1.518,457 1.732,458 2.399,459 1.383,462 41.973,463 1.614,464 3.562,465 3.979,466 4.287,467 4.364,468 4.364,469 1.577,470 2.503,471 3.787,472 2.382,473 216.754,474 6.351,475 1676.59,476 122.211,477 1.835,478 3.673,479 0.267,481 0.116,482 0.068,483 0.073,484 0.035,485 0.04,489 0.599,490 0.67,491 0.788,492 50.623,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.15,498 0.097,499 0.103,500 -0.073,501 0.179,502 0.045,503 0.024,504 0.112,505 0.158,506 -0.218,507 -0.115,508 -0.335,509 0.162,510 -0.288,511 -0.179,512 0.088,513 -0.042,514 0.074,515 -0.088,516 0.055,517 -0.372,518 -0.162,519 -0.452,520 -0.202,521 -0.289,522 -0.329,523 -0.009,524 -0.077,525 0.037,526 -0.027,527 -0.044,528 0.007,529 0.11,530 0.076,531 0.254,532 0.158,533 0.034,534 0.225,535 0.406,536 0.458,537 1.13,538 0.826,539 0.345,540 1.089,541 2.261,542 4.561,543 0.714,544 5.755,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.178,552 3.434,553 3.638,554 3.829,555 3.784,556 3.584,557 3.401,558 3.219,559 2.485,560 3.193,561 0.619,562 192.24,563 2.773,564 4.344,565 5.209,566 6.125,567 7.011,568 7.928,569 8.82,570 9.737,571 10.631,572 11.547,573 7.7,574 1,578 1,579 4,580 2,582 1,586 26,587 7,588 15,589 27,590 10,591 2,592 4,594 2,595 3,597 1,598 1,599 1,601 1,602 7,603 3,604 1,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,633 1,636 1,637 1,639 7.7,640 1,642 1,645 8.083,646 4.733,647 2.958,648 1.39,649 1.364,650 1.238,651 0.9,652 1.925,653 7.1,654 2.996,655 3.57,656 4.073,657 4.498,658 4.984,659 5.022,660 5.169,661 5.278,662 5.238,663 4.602,664 0.5,665 24,666 5.187,667 0.002,668 2.309,669 8.125,670 9.564,671 0.001,672 8.008,673 -0.001,674 2.625,675 36.75,676 0.003,677 105.94,678 59.912,679 32.897,681 67.951,683 59.912,684 173.891,685 32.897,686 8.825,687 35.432,688 80.711,689 29.85,690 5.942,692 105.94,694 105.94,695 92.809,696 67.951,698 47.084,699 84,700 42.806,701 44.257,702 48.552,704 105.94,705 100.848,706 59.912,707 105.94,708 13.182,709 46.73,710 100.848,711 105.94,712 100.848,713 59.912,714 0.612,715 0.367,716 0.181,717 0.095,718 13,719 6,722 1,723 1.2,724 2.443,725 93.04,726 0.2,727 10,728 53.303,729 9.339,730 2.885,731 1.372,732 100.848,733 7.186,734 1.417,735 75.703,736 266.699,737 19,738 11.561,740 -0.462,741 26.276,742 29.491,743 0.343,744 0.758,745 0.847,746 0.912,747 0.928,748 0.928,749 4.284,750 -0.791,751 5.303,752 -0.118,753 3.85,754 4.248,755 2.543,756 6.248,757 3.819,758 5.534,759 -1,760 6.973,761 -1.954,762 3.892,763 4.248,764 2.078,765 7.67,766 3.827,767 6.891,768 -1,769 8.76,770 -2.772,771 5.659,772 6.394,773 3.726,774 10.72,775 5.587,776 8.282,777 -1.31,778 10.613,779 -3,780 6.447,781 7.11,782 3.934,783 12.852,784 6.348,785 9.705,786 -1.57,787 12.505,788 -3.415,789 7.829,790 8.835,791 5.161,792 15.548,793 7.717,794 11.149,795 -1.76,796 14.422,797 -5.065,798 8.895,799 9.863,800 5.695,801 17.929,802 8.761,803 12.609,804 -2,805 16.356,806 -5.821,807 10.166,808 11.417,809 6.718,810 20.523,811 10.017,812 3.479,813 -2,814 18.302,815 -6.053,816 11.337,817 12.598,818 7.405,819 23,820 11.168,821 2.762,822 12.806,823 20.259,824 -8.173,825 12.579,826 14.07,827 8.33,828 25.562,829 12.394,830 2.167,831 9.515,832 22.222,833 3.985,834 13.79,835 15.332,836 9.089,837 28.08,838 13.587,839 1.436,840 6.753,841 24.192,842 3.4,843 15.028,844 16.761,845 9.966,846 30.632,847 14.807,848 1.186,849 3.261,850 26.166,851 2.475,852 16.257,853 18.07,854 10.76,855 33.167,856 16.018,857 0.446,858 3.001,859 28.145,860 2.059,861 17.495,862 19.475,863 11.613,864 35.716,865 17.239,866 -0.044,867 1.034,868 30.127,869 1.652,870 18.732,871 20.812,872 12.425,873 38.259,874 18.458,875 1159,876 2068,877 9.246,878 16.727,879 23.709,880 26.07,881 24.551,882 23.046,883 22.951,884 28.303,885 7.256,886 72.742,887 22.652,888 5.555,889 6.399,890 7.078,891 5.501,892 5.479,893 6.985,894 3.935,895 20.979,896 5.416,897 7.621,898 1.581,899 1.738,900 1.637,901 1.536,902 1.53,903 1.887,904 0.484,905 4.849,906 1.51,907 4.005,908 4.035,909 3.952,910 3.914,911 7.429,912 3.917,913 3.62,914 3.667,915 3.531,916 3.482,917 6.465,918 3.486,919 3.17,920 3.22,921 3.072,922 2.878,923 4.998,924 2.911,925 2.968,926 3.052,927 2.791,928 2.817,929 4.693,930 2.8,931 2.749,932 2.891,933 2.608,934 2.531,935 3.845,936 2.549,937 2.712,938 2.778,939 2.401,940 2.348,941 3.652,942 2.342,943 2.506,944 2.562,945 2.296,946 2.067,947 3.583,948 2.078,949 2.28,950 2.363,951 2.002,952 1.757,953 2.907,954 1.851,955 0.307,956 0.293,957 0.493,958 0.298,959 0.232,960 4.609,961 0.266,962 4.399,963 0.153,964 7.397,965 0.854,966 4.463,967 0.228,968 3.479,969 3.985,970 2.291,971 12.806,972 3.416,973 1.963,974 1.936,975 2.071,976 2.08,977 1.281,978 2.076,979 1.595,980 1.549,981 1.797,982 1.766,983 0.91,984 1.778,985 1.026,986 0.976,987 1.368,988 1.386,989 0.503,990 1.333,991 1.001,992 0.921,993 1.212,994 1.216,995 0.236,996 1.261,997 0.704,998 0.646,999 1.106,1000 1.121,1002 1.138,1003 0.653,1004 0.525,1005 0.96,1006 0.935,1008 0.962,1009 0.39,1010 0.269,1011 0.739,1012 0.809,1014 0.744,1015 0.113,1016 0.05,1017 0.559,1018 0.605,1020 0.631,1021 3.434,1022 4.812,1023 6.409,1024 8.104,1025 9.849,1026 1.62,1029 5.775,1030 9.569,1031 0.457,1034 0.638,1035 -1.011,1036 16.106,1037 41.973,1038 92.602,1039 103.457,1040 111.457,1041 113.457,1042 113.457,1043 27.498,1044 5.737,1045 66.56,1046 66.56,1047 12,1048 12.062,1049 3,1050 2.322,1051 21.09,1052 30,1053 16,1054 0.431,1055 101.779,1056 174.96,1057 240.1,1058 1618,1060 10.345,1061 0.739,1062 0.564,1063 10.345,1064 7.897,1065 6.522,1066 0.435,1067 0.295,1068 4.366,1069 6.269,1070 4.22,1071 3.518,1072 6.522,1073 4.424,1074 6.549,1075 0.285,1076 0.167,1077 6.549,1078 3.84,1079 5.453,1080 0.182,1081 0.082,1082 5.453,1083 2.458,1084 4.126,1085 0.112,1086 0.046,1087 4.126,1088 1.69,1089 3.127,1090 0.069,1091 0.025,1092 3.127,1093 1.129,1094 0.605,1095 41.157,1096 0.329,1097 13.474,1098 1.41,1099 76,1100 224.843,1101 84.093,1102 219.437,1103 291.86,1104 200,1105 91,1106 217.114,1107 100.672,1108 219.29,1109 318.93,1110 204,1111 5}
{0 CHEMBL2047855,1 1.614,2 5,3 0.268,4 0.072,5 51.866,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.582,13 2.862,14 3.871,15 4.031,16 3.3,17 3.284,18 4.982,19 3.254,20 4.206,21 4.393,22 3.492,23 3.446,24 5.562,25 3.41,26 4.288,27 4.499,28 3.264,29 3.355,30 5.572,31 3.288,32 4.165,33 4.426,34 2.728,35 3.044,36 5.347,37 2.911,38 3.679,39 3.997,40 1.718,41 2.385,42 4.7,43 2.144,44 2.764,45 3.175,46 0.381,47 1.364,48 3.332,49 1.011,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.105,57 0.382,58 5.588,59 2.265,60 12.534,61 3.008,62 0.119,63 0.603,64 9.593,65 3.864,66 17.273,67 5.313,68 0.31,69 0.758,70 14.534,71 5.056,72 60.485,73 7.07,74 0.347,75 0.736,76 16.741,77 4.929,78 58.298,79 6.997,80 0.363,81 0.562,82 16.09,83 4.329,84 58.736,85 6.305,86 0.242,87 0.301,88 10.535,89 2.703,90 42.016,91 4.181,92 0.09,93 0.101,94 4.473,95 1.07,96 15.67,97 1.876,98 0.009,99 0.011,100 0.565,101 0.138,102 1.52,103 0.254,104 17,105 22,106 0.326,107 0.719,108 0.819,109 0.881,110 0.896,111 0.896,112 2.738,113 0.9,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,120 1,123 1,128 4,129 1,130 1,135 1,137 6,139 1,140 2,142 1,143 6,144 1,146 4,148 2,149 3,150 4,151 5,153 2,155 5,158 1,159 4,160 1,161 3,163 1,165 2,168 4,169 1,171 2,173 1,177 1,179 1,194 120,195 9.104,196 9.104,197 9.104,198 9.104,199 9.104,200 8.297,201 10.488,202 5.129,203 9.184,204 7.3,205 7.3,206 7.3,207 7.3,208 7.3,209 5.99,210 9.309,211 2.358,212 7.402,213 3.086,214 1.139,215 0.644,216 0.337,217 0.26,218 0.26,219 3.368,221 144,222 1.732,223 56.608,224 48.792,226 0.571,227 19.294,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 70,235 4.489,236 4.336,237 6.912,238 4.258,239 3.276,240 3.978,241 2.291,242 11.415,243 3.215,244 3.764,245 3.369,246 5.927,247 3.427,248 2.425,249 3.049,250 1.257,251 7.898,252 2.425,253 3.427,254 3.055,255 5.845,256 3.306,257 2.334,258 2.518,259 0.08,260 7.55,261 2.261,262 2.909,263 2.166,264 4.029,265 2.461,266 1.463,267 2.072,269 3.152,270 1.459,271 2.523,272 1.508,273 3.86,274 2.099,275 1.1,276 1.511,278 2.837,279 1.096,280 1.868,281 1.405,282 3.443,283 1.584,284 0.579,285 0.666,286 1.406,287 0.579,288 1.558,289 0.765,290 2.912,291 1.296,292 0.274,293 0.337,294 0.596,295 0.276,296 0.735,297 0.104,298 2,299 0.398,300 -0.595,301 -0.716,302 -1.386,303 -0.589,304 0.565,305 -0.343,306 2,307 0.109,308 -0.888,309 -1.212,310 -2.127,311 -0.884,313 -0.751,314 1.765,315 -0.243,316 -1.265,317 -1.365,318 -3.082,319 -1.263,320 -0.301,321 -0.958,322 1.35,323 -0.39,324 -1.374,325 -1.648,326 -3.653,327 -1.364,328 -0.499,329 -1.323,330 1.286,331 -0.606,332 -1.589,333 -1.849,335 -4.819,336 -1.582,337 -0.5,338 -1.496,339 1.186,340 -0.763,341 -1.74,342 -2.153,343 -0.67,344 -5.844,345 -1.683,346 -0.591,347 -1.675,348 1.163,349 -1,350 -2,351 -2.188,352 -1.313,353 -5.944,354 -1.946,355 -0.947,356 -2,357 0.321,358 -1.039,359 -2,360 -3,361 -1.645,362 -8,363 -2,364 6.467,365 0.462,366 0.46,367 0.033,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.761,375 0.697,376 15.733,377 0.605,378 10.697,379 0.764,380 3.305,381 0.236,382 3.321,383 0.237,384 0.242,386 0.448,389 0.743,390 1.071,391 0.831,392 0.922,393 0.824,394 0.893,395 0.568,396 1.203,397 0.75,398 1.082,399 0.607,400 0.969,401 0.69,402 1.146,403 0.829,404 1.113,405 0.686,406 1.016,407 1.281,408 1.136,409 1.222,410 1.169,411 1.227,412 1.176,413 1.45,414 0.91,415 1.266,416 0.993,417 1.391,418 1.081,419 1.23,420 0.738,421 1.121,422 0.823,423 1.279,424 0.943,425 0.523,426 0.238,427 0.53,428 0.299,429 0.635,430 0.396,437 2.5,439 2.444,440 1.625,441 1.209,442 0.292,443 0.08,447 1061,448 3241,449 1.952,450 46.2,451 3,452 5,454 3,455 1,456 1.519,457 1.75,458 2.395,459 1.383,462 41.973,463 1.614,464 3.562,465 4.056,466 4.364,467 4.441,468 4.441,469 1.557,470 2.522,471 3.787,472 2.35,473 213.814,474 6.357,475 1671.86,476 122.211,477 1.557,478 3.689,479 0.167,481 0.111,482 0.065,483 0.067,484 0.032,485 0.04,489 0.482,490 0.67,491 0.788,492 50.566,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.14,498 0.097,499 0.079,500 -0.041,501 0.093,502 0.006,503 -0.01,504 0.044,505 0.208,506 -0.086,507 0.087,508 -0.104,509 0.215,510 -0.046,511 -0.165,512 -0.154,513 -0.253,514 -0.237,515 -0.096,516 -0.256,517 -0.258,518 -0.077,519 -0.237,520 -0.105,521 -0.181,522 -0.157,523 -0.156,524 -0.037,525 -0.053,526 0.037,527 -0.168,528 0.012,529 0.141,530 0.329,531 0.577,532 0.52,533 0.072,534 0.627,535 0.406,536 0.458,537 1.13,538 0.826,539 0.342,540 1.089,541 2.115,542 4.449,543 0.714,544 5.796,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.135,552 3.466,553 3.664,554 3.85,555 3.761,556 3.584,557 3.367,558 3.258,559 2.565,560 3.167,561 0.619,562 192.24,563 2.773,564 4.317,565 5.198,566 6.094,567 6.991,568 7.891,569 8.791,570 9.692,571 10.593,572 11.494,573 7.7,574 1,578 1,579 4,580 2,582 1,586 26,587 7,588 15,589 27,590 10,591 2,592 4,594 2,595 3,597 1,598 1,599 1,601 1,602 7,603 3,604 1,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,635 2,636 1,639 7.7,640 1,642 1,645 8,646 4.65,647 3.083,648 1.466,649 1.365,650 1.238,651 0.909,652 2.114,653 7.108,654 2.996,655 3.541,656 4.09,657 4.542,658 5.003,659 5.035,660 5.176,661 5.22,662 5.251,663 4.744,664 0.5,665 25,666 5.182,667 0.002,668 2.284,669 8.119,670 9.585,671 0.001,672 8.009,673 -0.001,674 2.619,675 36.667,676 0.003,677 105.94,678 57.377,679 32.897,681 67.951,683 57.377,684 173.891,685 32.897,686 8.825,687 32.897,688 80.711,689 29.85,690 5.942,692 105.94,694 105.94,695 90.274,696 67.951,698 94.169,699 36.916,700 42.806,701 41.722,702 48.552,704 105.94,705 100.848,706 57.377,707 105.94,708 10.647,709 46.73,710 100.848,711 105.94,712 100.848,713 57.377,714 0.6,715 0.387,716 0.197,717 0.101,718 12,719 6,722 1,723 1.2,724 2.454,725 92.703,726 0.2,727 10,728 53.303,729 9.339,730 3.17,731 1.281,732 100.848,733 7.218,734 1.439,735 75.703,736 264.165,737 19,738 11.449,740 -0.448,741 26.276,742 29.491,743 0.343,744 0.758,745 0.863,746 0.928,747 0.945,748 0.945,749 4.256,750 -0.595,751 5.231,752 0.596,753 3.807,754 4.22,755 2.543,756 6.125,757 3.779,758 5.461,759 -0.888,760 6.864,761 -1.386,762 3.611,763 4.06,764 2.078,765 7.204,766 3.559,767 6.777,768 -1.265,769 8.601,770 -2.127,771 5.485,772 6.314,773 3.726,774 10.362,775 5.421,776 8.13,777 -1.374,778 10.393,779 -3.082,780 6.089,781 6.935,782 3.934,783 12.201,784 6.001,785 9.516,786 -1.589,787 12.218,788 -3.653,789 7.494,790 8.719,791 5.161,792 14.916,793 7.391,794 10.924,795 -1.74,796 14.064,797 -4.819,798 8.432,799 9.697,800 5.695,801 17.07,802 8.307,803 12.351,804 -2,805 15.925,806 -5.844,807 9.682,808 11.288,809 6.718,810 19.627,811 9.54,812 3.276,813 -2,814 17.796,815 -5.944,816 10.762,817 12.448,818 7.405,819 21.929,820 10.598,821 2.425,822 11.415,823 19.677,824 -8,825 11.962,826 13.944,827 8.33,828 24.42,829 11.78,830 2.334,831 7.898,832 21.564,833 3.978,834 13.102,835 15.201,836 9.089,837 26.791,838 12.9,839 1.463,840 7.55,841 23.458,842 3.049,843 14.289,844 16.647,845 9.966,846 29.253,847 14.067,848 1.1,849 3.152,850 25.356,851 2.518,852 15.455,853 17.957,854 10.76,855 31.657,856 15.213,857 0.579,858 2.837,859 27.259,860 2.072,861 16.638,862 19.375,863 11.613,864 34.105,865 16.378,866 0.274,867 1.406,868 29.166,869 1.511,870 17.815,871 20.716,872 12.425,873 36.526,874 17.535,875 1152,876 2067,877 9.364,878 16.727,879 23.342,880 25.589,881 24.834,882 22.957,883 22.9,884 28.262,885 7.256,886 69.708,887 22.624,888 5.436,889 6.336,890 6.591,891 5.297,892 5.276,893 6.978,894 3.935,895 19.415,896 5.215,897 7.681,898 1.556,899 1.706,900 1.656,901 1.53,902 1.527,903 1.884,904 0.484,905 4.647,906 1.508,907 4.007,908 4.038,909 3.955,910 3.92,911 7.429,912 3.923,913 3.578,914 3.627,915 3.487,916 3.437,917 6.465,918 3.439,919 3.27,920 3.329,921 3.146,922 3.014,923 4.988,924 3.037,925 2.982,926 3.091,927 2.808,928 2.723,929 4.695,930 2.725,931 2.778,932 2.858,933 2.601,934 2.613,935 3.97,936 2.601,937 2.647,938 2.69,939 2.484,940 2.339,941 3.645,942 2.375,943 2.46,944 2.529,945 2.255,946 1.892,947 3.457,948 1.952,949 2.102,950 2.223,951 1.739,952 1.671,953 2.814,954 1.695,955 0.299,956 0.289,957 0.461,958 0.284,959 0.218,960 4.489,961 0.265,962 4.336,963 0.153,964 6.912,965 0.761,966 4.258,967 0.214,968 3.276,969 3.978,970 2.291,971 11.415,972 3.215,973 1.969,974 1.942,975 2.077,976 2.082,977 1.308,978 2.079,979 1.556,980 1.508,981 1.769,982 1.73,983 0.889,984 1.742,985 1.188,986 1.127,987 1.469,988 1.491,989 0.498,990 1.487,991 0.905,992 0.824,993 1.171,994 1.283,995 0.217,996 1.25,997 0.78,998 0.705,999 1.079,1000 1.007,1001 0.104,1002 1.047,1003 0.563,1004 0.499,1005 0.823,1006 0.844,1008 0.835,1009 0.268,1010 0.15,1011 0.754,1012 0.806,1014 0.782,1015 0.035,1017 0.533,1018 0.49,1020 0.522,1021 3.434,1022 4.779,1023 6.358,1024 8.043,1025 9.782,1026 1.883,1029 5.676,1030 9.522,1033 -0.711,1034 0.639,1036 16.106,1037 41.973,1038 92.602,1039 105.457,1040 113.457,1041 115.457,1042 115.457,1043 26.652,1044 5.743,1045 66.56,1046 66.56,1047 12,1048 12.015,1049 3,1050 2.322,1051 21.046,1052 29,1053 16,1054 0.434,1055 101.779,1056 174.96,1057 240.1,1058 1633,1060 10.293,1061 0.735,1062 0.56,1063 10.293,1064 7.844,1065 6.626,1066 0.442,1067 0.3,1068 4.44,1069 6.37,1070 4.324,1071 3.595,1072 6.626,1073 4.5,1074 6.049,1075 0.275,1076 0.16,1077 6.049,1078 3.523,1079 5.714,1080 0.184,1081 0.087,1082 5.714,1083 2.688,1084 4.231,1085 0.111,1086 0.046,1087 4.231,1088 1.733,1089 3.235,1090 0.07,1091 0.024,1092 3.235,1093 1.124,1094 0.607,1095 41.821,1096 0.327,1097 13.451,1098 1.432,1099 74,1100 222.843,1101 81.76,1102 215.952,1103 288.42,1104 198,1105 90,1106 213.902,1107 99.174,1108 213.646,1109 313.27,1110 201,1111 5.876}
{0 CHEMBL2047856,1 1.869,2 5.071,3 0.154,4 0.024,5 47.611,6 8.53,7 0.4,8 3.292,9 3.402,10 2.933,11 2.764,12 4.618,13 2.794,14 3.77,15 3.906,16 3.33,17 3.157,18 5.075,19 3.178,20 4.104,21 4.275,22 3.505,23 3.257,24 5.646,25 3.283,26 4.105,27 4.297,28 3.309,29 3.055,30 5.7,31 3.091,32 3.842,33 4.052,34 2.76,35 2.681,36 5.468,37 2.668,38 3.356,39 3.664,40 1.896,41 2.054,42 4.721,43 1.912,44 2.444,45 2.773,46 0.514,47 1.097,48 3.584,49 0.929,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.165,57 0.412,58 3.918,59 1.957,60 24.313,61 2.162,62 0.239,63 0.649,64 6.809,65 3.317,66 35.72,67 3.885,68 0.542,69 0.785,70 11.74,71 4.239,72 90.484,73 5.143,74 0.69,75 0.69,76 13.545,77 3.842,78 114.887,79 4.461,80 0.644,81 0.484,82 11.434,83 3.027,84 113.496,85 3.297,86 0.338,87 0.238,88 8.474,89 1.872,90 58.809,91 2.909,92 0.167,93 0.091,94 3.698,95 0.708,96 29.093,97 0.94,98 0.019,99 0.007,100 0.784,101 0.143,102 3.071,103 0.3,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.834,114 -2.37,115 -2.41,116 -2.36,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 4,139 1,140 1,142 1,143 3,144 1,146 4,148 2,149 3,150 2,151 2,153 1,155 2,158 1,159 4,160 1,161 1,163 1,165 2,168 2,171 1,173 1,177 1,179 1,194 140,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 9.232,202 5.096,203 9.183,204 7.326,205 7.326,206 7.326,207 7.326,208 7.326,209 5.915,210 7.706,211 2.358,212 7.536,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 28.513,228 0.67,229 0.83,230 0.8,232 0.76,233 32.5,234 71,235 4.5,236 4.336,237 6.865,238 4.204,239 3.234,240 4.088,241 2.291,242 11.294,243 3.132,244 3.845,245 3.345,246 5.979,247 3.534,248 2.548,249 3.099,250 1.257,251 8.069,252 2.502,253 3.326,254 3.096,255 5.233,256 3.052,257 2.078,258 2.556,259 0.08,260 6.224,261 2.013,262 2.989,263 2.507,264 4.774,265 2.68,266 1.733,267 2.126,269 4.771,270 1.63,271 2.622,272 1.859,273 3.829,274 2.252,275 1.262,276 1.634,278 2.912,279 1.241,280 1.884,281 1.405,282 3.146,283 1.471,284 0.425,285 0.549,286 0.961,287 0.436,288 1.083,289 0.903,290 2.844,291 0.876,292 -0.092,293 -0.101,294 -0.243,295 -0.088,296 1,297 0.147,298 2.347,299 0.604,300 -0.313,301 -0.387,302 -0.699,303 -0.28,304 0.361,305 -0.09,306 1.866,307 0.059,308 -0.912,309 -1.072,310 -2.303,311 -0.879,313 -0.639,314 1.728,315 -0.253,316 -1.297,317 -1.513,318 -3.328,319 -1.233,320 -0.1,321 -0.876,322 1.37,323 -0.474,324 -1.373,325 -1.767,326 -3.434,327 -1.35,328 -0.454,329 -1.15,330 1.267,331 -0.562,332 -1.528,333 -1.836,335 -4.611,336 -1.485,337 -0.5,338 -1.505,339 1.205,340 -0.804,341 -1.766,342 -2.169,343 -0.67,344 -5.426,345 -1.693,346 -0.611,347 -1.67,348 1.083,349 -1,350 -2,351 -2.205,352 -1.313,353 -6.668,354 -1.947,355 -0.946,356 -2,357 0.464,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.519,363 -2,364 6.252,365 0.447,366 0.477,367 0.034,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 8.953,375 0.64,376 15.948,377 0.693,378 11.403,379 0.814,380 3.555,381 0.254,382 3.054,383 0.218,384 0.216,386 0.464,388 1,389 0.67,390 0.919,391 0.698,392 0.859,393 0.709,394 0.801,395 0.609,396 1.119,397 0.673,398 1.138,399 0.615,400 0.984,401 0.766,402 1.02,403 0.822,404 1.128,405 0.814,406 1.036,407 1.209,408 1.091,409 1.104,410 1.036,411 1.165,412 1.026,413 1.57,414 1.132,415 1.515,416 1.055,417 1.482,418 1.209,419 0.875,420 0.617,421 0.987,422 0.772,423 0.932,424 0.903,425 1.717,426 0.816,427 1.569,428 0.476,429 1.776,430 0.811,437 3,439 2.222,440 1.625,441 1.209,442 0.347,443 0.08,447 1073,448 4291,449 1.952,450 39.1,452 4,454 3,455 2,456 1.518,457 1.75,458 2.405,459 1.453,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.577,470 3.039,471 3.787,472 2.386,473 217.116,474 6.352,475 1689.57,476 104.042,477 1.557,478 3.689,479 0.2,481 0.101,482 0.068,483 0.067,484 0.039,485 0.027,489 0.501,490 0.67,491 0.788,492 50.723,493 -0.045,494 0.095,495 -0.028,496 0.203,497 -0.115,498 0.124,499 0.013,500 -0.13,501 0.054,502 -0.08,503 -0.014,504 -0.017,505 0.106,506 -0.06,507 0.06,508 -0.158,509 0.06,510 -0.097,511 -0.1,512 -0.159,513 -0.099,514 -0.131,515 -0.04,516 -0.116,517 -0.249,518 -0.047,519 -0.429,520 -0.135,521 -0.174,522 -0.297,523 0.06,524 0.073,525 0.215,526 0.094,527 0.039,528 0.176,529 -0.37,530 0.292,531 -0.207,532 0.393,533 -0.4,534 0.246,535 0.469,536 0.184,537 1.447,538 0.846,539 0.393,540 1.39,541 2.345,542 5.227,543 0.714,544 5.714,545 1.039,546 1.149,547 1.142,548 1.305,549 0.648,550 2.773,551 3.135,552 3.434,553 3.664,554 3.829,555 3.784,556 3.584,557 3.466,558 3.296,559 2.639,560 3.214,561 0.651,562 196.2,563 2.773,564 4.317,565 5.187,566 6.084,567 6.971,568 7.872,569 8.761,570 9.664,571 10.554,572 11.456,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,611 1,612 9,613 5,614 3,615 5,617 2,619 2,620 2,621 1,625 1,626 1,627 1,630 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.056,648 1.217,649 1.384,650 1.241,651 0.926,652 2.077,653 7.137,654 2.996,655 3.57,656 4.107,657 4.573,658 5.037,659 5.098,660 5.174,661 5.3,662 5.332,663 4.676,664 0.5,665 24,666 5.214,667 0.002,668 2.387,669 8.536,670 9.249,671 0.001,672 7.69,673 -0.001,674 3.036,675 42.5,676 0.002,677 70.627,678 50.731,679 32.897,681 67.951,682 14.96,683 50.731,684 138.577,685 47.857,687 35.432,688 71.234,689 29.85,690 15.063,691 14.96,692 70.627,694 70.627,695 83.628,696 82.911,698 62.045,699 48.687,700 42.806,701 35.432,702 48.197,704 85.587,705 100.848,706 50.731,707 70.627,708 22.303,709 28.429,710 115.808,711 70.627,712 115.808,713 50.731,714 0.601,715 0.374,716 0.195,717 0.098,718 12,719 6,722 1,723 1.2,724 2.463,725 92.249,726 0.2,727 10,728 53.303,729 9.276,730 3.134,731 1.353,732 115.808,733 4.338,734 -0.163,735 75.703,736 237.166,737 19,738 11.224,740 -0.678,741 23.905,742 26.416,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.313,751 5.22,752 -0.243,753 3.807,754 4.248,755 2.543,756 6.098,757 3.751,758 5.473,759 -0.912,760 6.838,761 -0.699,762 3.611,763 4.182,764 2.078,765 7.149,766 3.507,767 6.797,768 -1.297,769 8.558,770 -2.303,771 5.468,772 6.392,773 3.726,774 10.288,775 5.357,776 8.156,777 -1.373,778 10.333,779 -3.328,780 6.043,781 7.091,782 3.934,783 12.128,784 5.884,785 9.546,786 -1.528,787 12.142,788 -3.434,789 7.446,790 8.85,791 5.161,792 14.819,793 7.274,794 10.958,795 -1.766,796 13.975,797 -4.611,798 8.36,799 9.901,800 5.695,801 16.991,802 8.143,803 12.388,804 -2,805 15.825,806 -5.426,807 9.604,808 11.478,809 6.718,810 19.52,811 9.367,812 3.234,813 -2,814 17.689,815 -6.668,816 10.664,817 12.701,818 7.405,819 21.836,820 10.386,821 2.548,822 11.294,823 19.563,824 -7.519,825 11.855,826 14.196,827 8.33,828 24.302,829 11.551,830 2.078,831 8.069,832 21.445,833 4.088,834 12.977,835 15.506,836 9.089,837 26.678,838 12.635,839 1.733,840 6.224,841 23.335,842 3.099,843 14.151,844 16.959,845 9.966,846 29.119,847 13.779,848 1.262,849 4.771,850 25.23,851 2.556,852 15.301,853 18.315,854 10.76,855 31.523,856 14.893,857 0.425,858 2.912,859 27.131,860 2.126,861 16.47,862 19.747,863 11.613,864 33.953,865 16.032,866 -0.092,867 0.961,868 29.035,869 1.634,870 17.632,871 21.126,872 12.425,873 36.368,874 17.159,875 1163,876 2380,877 9.364,878 14.904,879 23.134,880 25.877,881 24.452,882 22.706,883 22.559,884 28.103,885 7.256,886 68.464,887 21.91,888 5.446,889 6.336,890 6.402,891 5.243,892 5.234,893 7.088,894 3.935,895 18.813,896 5.132,897 7.77,898 1.542,899 1.725,900 1.63,901 1.514,902 1.504,903 1.874,904 0.484,905 4.564,906 1.461,907 3.999,908 4.028,909 3.959,910 3.902,911 8.201,912 3.909,913 3.565,914 3.61,915 3.491,916 3.389,917 7.429,918 3.404,919 3.141,920 3.193,921 3.051,922 2.872,923 6.465,924 2.906,925 2.893,926 2.99,927 2.76,928 2.677,929 4.986,930 2.684,931 2.768,932 2.811,933 2.685,934 2.47,935 4.589,936 2.515,937 2.519,938 2.598,939 2.318,940 2.067,941 3.742,942 2.078,943 2.295,944 2.37,945 2.024,946 1.758,947 3.393,948 1.855,949 1.733,950 1.888,951 1.607,952 1.254,953 3.018,954 1.234,955 0.3,956 0.289,957 0.458,958 0.28,959 0.216,960 4.5,961 0.273,962 4.336,963 0.153,964 6.865,965 0.753,966 4.204,967 0.209,968 3.234,969 4.088,970 2.291,971 11.294,972 3.132,973 1.947,974 1.922,975 2.042,976 2.071,977 1.259,978 2.06,979 1.506,980 1.461,981 1.69,982 1.712,983 0.822,984 1.706,985 1,986 0.957,987 1.194,988 1.353,989 0.229,990 1.289,991 0.839,992 0.762,993 1.12,994 1.154,995 0.109,996 1.172,997 0.643,998 0.592,999 0.912,1000 0.943,1002 0.924,1003 0.405,1004 0.271,1005 0.766,1006 0.838,1008 0.795,1009 0.112,1010 0.047,1011 0.587,1012 0.618,1014 0.625,1017 0.314,1018 0.192,1020 0.245,1021 3.434,1022 4.779,1023 6.347,1024 8.022,1025 9.749,1028 13.227,1029 5.46,1030 9.345,1031 0.253,1033 -0.797,1034 0.291,1036 14.963,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 33.117,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.979,1049 3,1050 2.322,1051 21.072,1052 28,1053 20,1054 0.427,1055 93.384,1056 163.73,1057 219.618,1058 1663,1059 4.3,1060 10.293,1061 0.735,1062 0.52,1063 9.422,1064 7.274,1065 6.609,1066 0.441,1067 0.278,1068 4.083,1069 6.242,1070 4.042,1071 3.312,1072 6.198,1073 4.168,1074 6.177,1075 0.281,1076 0.146,1077 5.64,1078 3.208,1079 5.444,1080 0.181,1081 0.075,1082 5.045,1083 2.248,1084 4.335,1085 0.114,1086 0.041,1087 3.821,1088 1.553,1089 3.154,1090 0.07,1091 0.022,1092 2.954,1093 1.008,1094 0.601,1095 42.586,1096 0.327,1097 13.486,1098 1.398,1099 74,1100 310.954,1101 85.59,1102 271.568,1103 349.81,1104 248,1105 89,1106 248.236,1107 101.763,1108 240.79,1109 353.61,1110 226,1111 6.2}
{0 CHEMBL2047857,1 1.681,2 5.4,3 -0.067,4 0.005,5 53.857,6 7.713,7 0.375,8 3.431,9 3.541,10 3.001,11 2.868,12 4.671,13 2.886,14 3.923,15 4.073,16 3.36,17 3.248,18 5.077,19 3.254,20 4.173,21 4.331,22 3.548,23 3.385,24 5.582,25 3.39,26 4.245,27 4.424,28 3.401,29 3.297,30 5.592,31 3.291,32 4.138,33 4.342,34 3.014,35 3.104,36 5.42,37 3.043,38 3.9,39 4.172,40 2.316,41 2.727,42 5.017,43 2.546,44 3.421,45 3.766,46 1.268,47 2.015,48 4.304,49 1.754,50 2.36,51 2.733,52 0.404,53 1.163,54 3.091,55 0.905,56 0.139,57 0.387,58 5.585,59 2.292,60 13.472,61 2.898,62 0.251,63 0.589,64 10.164,65 3.714,66 22.877,67 4.886,68 0.424,69 0.706,70 13.471,71 4.604,72 61.638,73 6.166,74 0.531,75 0.669,76 15.684,77 4.445,78 62.248,79 6.042,80 0.533,81 0.554,82 14.906,83 4.018,84 53.678,85 5.503,86 0.371,87 0.39,88 12.713,89 3.467,90 48.007,91 5.212,92 0.276,93 0.2,94 8.972,95 1.89,96 39.351,97 3.18,98 0.069,99 0.077,100 2.834,101 0.521,102 10.185,103 1.063,104 18,105 23,106 0.336,107 0.751,108 0.851,109 0.886,110 0.886,111 0.886,112 2.798,113 0.861,114 -1.73,115 -1.8,116 -1.82,117 37,119 1,121 1,123 1,128 3,129 1,130 2,135 1,137 4,139 1,140 2,142 1,143 3,144 1,145 1,146 6,148 2,149 3,150 2,151 2,153 1,155 4,157 1,158 1,159 4,160 1,161 1,163 1,164 1,165 2,168 2,171 1,173 1,175 1,176 1,177 1,179 1,194 187,195 9.922,196 9.922,197 9.922,198 9.922,199 9.922,200 9.089,201 11.82,202 5.619,203 10.174,204 7.763,205 7.763,206 7.763,207 7.763,208 7.763,209 6.341,210 11.613,211 2.512,212 8.043,213 3.074,214 1.001,215 0.5,216 0.324,217 0.324,218 0.324,219 3.436,221 165,222 2,223 62.392,224 53.803,226 0.827,227 22.485,228 1,229 1,230 1,231 0.5,232 0.93,233 34,234 81,235 4.512,236 4.335,237 6.888,238 4.214,239 3.244,240 4.101,241 2.291,242 11.421,243 3.145,244 3.86,245 3.34,246 6.009,247 3.561,248 2.577,249 3.108,250 1.257,251 8.208,252 2.529,253 3.364,254 3.059,255 5.264,256 3.073,257 2.097,258 2.602,259 0.86,260 6.348,261 2.039,262 3.002,263 2.498,264 4.945,265 2.752,266 1.81,267 2.13,268 0.08,269 5.173,270 1.699,271 2.651,272 1.876,273 3.835,274 2.276,275 1.285,276 1.669,278 2.927,279 1.269,280 1.925,281 1.406,282 3.154,283 1.535,284 0.572,285 0.678,286 1.124,287 0.531,288 1.563,289 1.209,290 3.037,291 1.279,292 0.316,293 0.379,294 0.57,295 0.305,296 1.083,297 0.535,298 2.54,299 0.854,300 -0.123,301 -0.14,302 -0.312,303 -0.12,304 0.694,305 -0.074,306 2.233,307 0.32,308 -0.622,309 -0.747,310 -1.283,311 -0.576,312 0.337,313 -0.222,314 1.733,315 0.036,316 -0.935,317 -1.11,318 -2.327,319 -0.903,321 -0.736,322 1.723,323 -0.253,324 -1.299,325 -1.547,326 -3.342,327 -1.348,328 -0.406,329 -0.878,330 1.363,331 -0.555,332 -1.512,333 -1.788,335 -4.141,336 -1.408,337 -0.482,338 -1.278,339 1.21,340 -0.669,341 -1.6,342 -1.929,343 -0.67,344 -4.629,345 -1.507,346 -0.5,347 -1.518,348 1.091,349 -0.884,350 -1.81,351 -2.174,352 -0.86,353 -5.441,354 -1.707,355 -0.657,356 -1.671,357 0.566,358 -1,359 -2,360 -2.231,361 -1.313,362 -6.771,363 -1.948,364 6.8,365 0.453,366 0.439,367 0.029,368 18.25,369 1.217,370 8.5,371 0.567,372 9.75,373 0.65,374 10.033,375 0.669,376 17.2,377 0.637,378 12.318,379 0.821,380 3.836,381 0.256,382 3.311,383 0.221,384 0.23,386 0.426,389 0.814,390 1.186,391 0.789,392 1.035,393 0.828,394 0.918,395 0.886,396 1.127,397 0.77,398 0.969,399 0.685,400 0.857,401 0.773,402 1.166,403 0.832,404 1.151,405 0.791,406 1.03,407 1.215,408 1.131,409 1.111,410 1.122,411 1.248,412 1.088,413 1.364,414 0.995,415 1.335,416 1.079,417 1.196,418 1.179,419 0.967,420 0.952,421 1.16,422 1.095,423 1.153,424 1.186,425 1.068,426 0.489,427 0.965,428 0.498,429 1.243,430 0.683,431 0.487,432 0.448,433 0.965,434 0.558,435 0.626,436 0.779,437 3,439 2.222,440 1.625,441 1.329,442 0.493,443 0.161,447 1294,448 4346,449 1.955,450 44.4,452 7,454 3,455 2,456 1.541,457 1.765,458 2.495,459 1.378,462 45.388,463 1.681,464 3.754,465 4.255,466 4.431,467 4.431,468 4.431,469 1.909,470 3.507,471 3.883,472 2.503,473 262.788,474 6.552,475 2135.93,476 128.382,477 1.566,478 3.796,479 0.188,481 0.097,482 0.063,483 0.063,484 0.038,485 0.032,489 0.48,490 0.67,491 1.029,492 56.327,493 -0.033,494 0.084,495 0.007,496 0.086,497 -0.138,498 0.063,499 -0.057,500 0.015,501 0.09,502 0.106,503 -0.045,504 0.132,505 0.157,506 -0.066,507 0.064,508 -0.129,509 0.17,510 -0.073,511 -0.084,512 -0.139,513 -0.145,514 -0.176,515 -0.064,516 -0.172,517 -0.2,518 -0.081,519 -0.339,520 -0.158,521 -0.125,522 -0.262,523 -0.04,524 -0.177,525 -0.133,526 -0.181,527 -0.087,528 -0.193,529 -0.106,530 0.122,531 0.176,532 0.312,533 -0.124,534 0.314,535 0.019,536 0.331,537 0.108,538 0.183,539 -0.072,540 0.204,541 2.174,542 4.451,543 0.667,544 6.631,545 1.022,546 1.137,547 0.505,548 0.255,549 0.636,550 2.833,551 3.178,552 3.497,553 3.738,554 3.932,555 3.892,556 3.761,557 3.611,558 3.497,559 2.944,560 3.425,561 0.623,562 208.24,563 2.833,564 4.369,565 5.242,566 6.138,567 7.029,568 7.931,569 8.825,570 9.728,571 10.624,572 11.527,573 7.4,574 1,578 1,579 3,580 3,582 1,584 1,586 27,587 7,588 16,589 28,590 10,591 3,592 3,594 2,595 3,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 5,614 3,615 5,617 2,619 3,620 2,621 1,625 1,626 1,627 1,628 1,631 15,632 1,633 1,634 1,635 1,636 1,639 11.1,640 1,642 1,644 1,645 8.5,646 4.9,647 3.389,648 1.39,649 1.389,650 1.236,651 0.907,652 2.542,653 7.278,654 3.045,655 3.597,656 4.155,657 4.634,658 5.112,659 5.196,660 5.32,661 5.4,662 5.467,663 5.002,664 0.75,665 26,666 5.539,667 -0.001,668 2.403,669 8.167,670 10.137,672 8.208,674 2.667,675 40,676 0.002,677 105.94,678 57.737,679 32.897,681 78.95,683 57.737,684 184.89,685 32.897,686 10.883,687 35.432,688 71.234,689 29.85,690 22.186,692 105.94,694 105.94,695 90.634,696 78.95,698 82.398,699 59.687,700 42.806,701 35.432,702 55.202,704 105.94,705 111.848,706 57.737,707 105.94,708 18.425,709 39.312,710 111.848,711 105.94,712 111.848,713 57.737,714 0.588,715 0.377,716 0.203,717 0.108,718 12,719 6,720 0.036,721 1,722 1,723 1.2,724 2.558,725 101.406,726 0.2,727 10,728 58.603,729 10.265,730 3.715,731 1.555,732 111.848,733 5.299,734 1.672,735 75.703,736 275.524,737 20,738 11.451,740 -0.507,741 27.604,742 30.701,743 0.354,744 0.79,745 0.895,746 0.932,747 0.932,748 0.932,749 4.297,750 -0.123,751 5.263,752 0.57,753 3.85,754 4.277,755 2.653,756 6.142,757 3.79,758 5.502,759 -0.622,760 6.878,761 -0.312,762 3.611,763 4.182,764 2.078,765 7.204,766 3.525,767 6.823,768 -0.935,769 8.597,770 -1.283,771 5.509,772 6.416,773 3.752,774 10.344,775 5.394,776 8.18,777 -1.299,778 10.372,779 -2.327,780 6.066,781 7.11,782 3.934,783 12.2,784 5.919,785 9.571,786 -1.512,787 12.182,788 -3.342,789 7.485,790 8.874,791 5.166,792 14.891,793 7.314,794 10.984,795 -1.6,796 14.015,797 -4.141,798 8.392,799 9.927,800 5.695,801 17.079,802 8.185,803 12.415,804 -1.81,805 15.867,806 -4.629,807 9.643,808 11.506,809 6.719,810 19.612,811 9.411,812 3.244,813 -2,814 17.732,815 -5.441,816 10.702,817 12.733,818 7.405,819 21.942,820 10.434,821 2.577,822 11.421,823 19.607,824 -6.771,825 11.895,826 14.228,827 8.33,828 24.414,829 11.599,830 2.097,831 8.208,832 21.492,833 4.101,834 13.019,835 15.543,836 9.089,837 26.805,838 12.688,839 1.81,840 6.348,841 23.383,842 3.108,843 14.195,844 16.998,845 9.966,846 29.254,847 13.835,848 1.285,849 5.173,850 25.281,851 2.602,852 15.346,853 18.358,854 10.76,855 31.67,856 14.952,857 0.572,858 2.927,859 27.183,860 2.13,861 16.518,862 19.791,863 11.613,864 34.11,865 16.094,866 0.316,867 1.124,868 29.089,869 1.669,870 17.682,871 21.175,872 12.425,873 36.537,874 17.225,875 1400,876 2624,877 10.057,878 17.182,879 24.254,880 26.8,881 26.014,882 23.819,883 23.802,884 29.334,885 8.976,886 71.541,887 23.035,888 5.458,889 6.335,890 6.479,891 5.254,892 5.244,893 7.101,894 3.935,895 18.945,896 5.145,897 8.337,898 1.516,899 1.675,900 1.626,901 1.489,902 1.488,903 1.833,904 0.561,905 4.471,906 1.44,907 4.001,908 4.026,909 3.956,910 3.903,911 7.429,912 3.911,913 3.573,914 3.615,915 3.494,916 3.393,917 6.465,918 3.409,919 3.26,920 3.318,921 3.114,922 2.992,923 4.99,924 3.01,925 3.087,926 3.158,927 2.927,928 2.767,929 4.819,930 2.785,931 2.878,932 2.968,933 2.738,934 2.673,935 4.366,936 2.683,937 2.652,938 2.7,939 2.487,940 2.422,941 3.742,942 2.436,943 2.508,944 2.593,945 2.287,946 2.067,947 3.454,948 2.077,949 2.289,950 2.36,951 2.021,952 1.752,953 3.018,954 1.847,955 0.282,956 0.271,957 0.43,958 0.263,959 0.203,960 4.512,961 0.256,962 4.335,963 0.143,964 6.888,965 0.714,966 4.214,967 0.197,968 3.244,969 4.101,970 2.291,971 11.421,972 3.145,973 1.949,974 1.926,975 2.046,976 2.072,977 1.265,978 2.062,979 1.512,980 1.469,981 1.702,982 1.729,983 0.838,984 1.72,985 1.199,986 1.132,987 1.563,988 1.504,989 0.571,990 1.523,991 0.953,992 0.894,993 1.187,994 1.34,995 0.233,996 1.275,997 0.839,998 0.761,999 1.112,1000 1.138,1001 0.114,1002 1.165,1003 0.6,1004 0.545,1005 0.903,1006 0.852,1008 0.865,1009 0.405,1010 0.271,1011 0.761,1012 0.829,1014 0.793,1015 0.108,1016 0.044,1017 0.585,1018 0.608,1020 0.617,1021 3.497,1022 4.828,1023 6.392,1024 8.065,1025 9.793,1026 1.489,1029 5.583,1030 9.636,1031 0.419,1032 5.072,1033 -0.686,1034 0.572,1036 16.821,1037 45.388,1038 101.362,1039 114.872,1040 119.627,1041 119.627,1042 119.627,1043 29.138,1044 5.889,1045 75.79,1046 75.79,1047 12,1048 12.048,1049 3,1050 2.322,1051 23.294,1052 31,1053 29,1054 0.412,1055 105.775,1056 183.75,1057 249.85,1058 1987,1060 11,1061 0.733,1062 0.554,1063 11,1064 8.305,1065 7.147,1066 0.447,1067 0.287,1068 4.49,1069 6.738,1070 4.384,1071 3.638,1072 7.147,1073 4.592,1074 6.368,1075 0.277,1076 0.149,1077 6.368,1078 3.429,1079 5.771,1080 0.18,1081 0.078,1082 5.771,1083 2.48,1084 4.583,1085 0.112,1086 0.042,1087 4.583,1088 1.729,1089 3.569,1090 0.071,1091 0.023,1092 3.569,1093 1.162,1094 0.584,1095 46.063,1096 0.315,1097 14.48,1098 1.334,1099 78,1100 272.578,1101 88.638,1102 255.752,1103 338.79,1104 236,1105 94,1106 245.448,1107 106.219,1108 244.74,1109 357.6,1110 228,1111 5}
{0 CHEMBL2047858,1 1.869,2 5.071,3 0.613,4 0.376,5 52.199,6 9.246,7 0.4,8 3.285,9 3.388,10 3.003,11 2.821,12 4.552,13 2.821,14 3.761,15 3.889,16 3.423,17 3.233,18 4.981,19 3.214,20 4.091,21 4.25,22 3.631,23 3.359,24 5.55,25 3.332,26 4.089,27 4.268,28 3.509,29 3.209,30 5.527,31 3.168,32 3.817,33 4.002,34 2.969,35 2.853,36 5.242,37 2.75,38 3.342,39 3.638,40 2.125,41 2.166,42 4.531,43 1.977,44 2.412,45 2.711,46 0.643,47 1.307,48 3.34,49 1.018,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.142,57 0.334,58 3.482,59 1.88,60 16.473,61 2.121,62 0.189,63 0.519,64 6.349,65 3.316,66 21.993,67 3.951,68 0.444,69 0.622,70 12.732,71 4.554,72 69.13,73 5.472,74 0.542,75 0.534,76 15.402,77 4.48,78 73.826,79 4.945,80 0.465,81 0.363,82 15.769,83 3.734,84 60.97,85 4.054,86 0.265,87 0.21,88 10.446,89 2.337,90 38.403,91 3.234,92 0.117,93 0.065,94 5.847,95 0.999,96 16.438,97 1.326,98 0.016,99 0.012,100 0.94,101 0.189,102 2.29,103 0.33,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.909,114 -2.52,115 -2.55,116 -2.49,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 4,139 1,140 1,142 1,143 4,144 1,146 5,148 2,149 3,150 2,151 4,153 1,155 2,158 1,159 5,160 1,161 3,163 1,165 3,168 2,171 1,173 1,177 2,179 2,194 140,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 9.21,202 5.096,203 9.244,204 7.326,205 7.326,206 7.326,207 7.326,208 7.326,209 5.915,210 7.675,211 2.358,212 7.663,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,220 1,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 22.233,228 0.83,229 1,230 0.8,232 0.8,233 31.333,234 71,235 4.5,236 4.336,237 6.865,238 4.197,239 3.234,240 4.088,241 2.291,242 11.294,243 3.111,244 3.845,245 3.346,246 5.979,247 3.521,248 2.548,249 3.099,250 1.257,251 8.069,252 2.465,253 3.326,254 3.106,255 5.233,256 3.044,257 2.078,258 2.556,259 0.08,260 6.224,261 1.986,262 2.989,263 2.519,264 4.774,265 2.651,266 1.733,267 2.126,269 4.771,270 1.544,271 2.622,272 1.862,273 3.829,274 2.242,275 1.262,276 1.634,278 2.912,279 1.205,280 1.884,281 1.405,282 3.146,283 1.466,284 0.425,285 0.549,286 0.961,287 0.426,288 1.083,289 0.913,290 2.844,291 0.87,292 -0.092,293 -0.101,294 -0.243,295 -0.082,296 1,297 0.155,298 2.347,299 0.529,300 -0.313,301 -0.387,302 -0.699,303 -0.226,304 0.361,305 -0.089,306 1.866,307 0.052,308 -0.912,309 -1.072,310 -2.303,311 -0.86,313 -0.636,314 1.728,315 -0.253,316 -1.297,317 -1.513,318 -3.328,319 -1.106,320 -0.1,321 -0.875,322 1.37,323 -0.548,324 -1.373,325 -1.767,326 -3.434,327 -1.35,328 -0.454,329 -1.147,330 1.267,331 -0.596,332 -1.528,333 -1.836,335 -4.611,336 -1.481,337 -0.5,338 -1.505,339 1.205,340 -0.837,341 -1.766,342 -2.169,343 -0.67,344 -5.426,345 -1.686,346 -0.611,347 -1.67,348 1.083,349 -1,350 -2,351 -2.205,352 -1.313,353 -6.668,354 -1.947,355 -0.946,356 -2,357 0.464,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.519,363 -2,364 6.681,365 0.477,366 0.477,367 0.034,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 9.666,375 0.69,376 15.519,377 0.675,378 10.69,379 0.764,380 3.424,381 0.245,382 3.185,383 0.228,384 0.267,386 0.434,389 0.728,390 1.014,391 0.57,392 0.69,393 0.807,394 0.725,395 0.608,396 1.242,397 0.586,398 0.926,399 0.625,400 0.892,401 0.745,402 1.118,403 0.798,404 1.04,405 0.77,406 0.994,407 1.298,408 0.967,409 1.031,410 0.948,411 1.277,412 0.979,413 1.521,414 0.997,415 1.678,416 1.344,417 1.396,418 1.344,419 0.911,420 0.756,421 0.943,422 0.891,423 1.028,424 0.938,425 1.319,426 0.403,427 2.202,428 1.181,429 1.227,430 1.198,437 3,439 2.222,440 1.625,441 1.209,442 0.347,443 0.08,447 1073,448 4291,449 1.952,450 39.1,452 4,454 3,455 2,456 1.518,457 1.75,458 2.405,459 1.453,461 1,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.577,470 3.039,471 3.787,472 2.386,473 217.116,474 6.352,475 1689.57,476 104.042,477 1.557,478 3.689,479 0.2,481 0.101,482 0.068,483 0.067,484 0.039,485 0.027,489 0.501,490 0.67,491 0.788,492 50.723,493 -0.04,494 0.22,495 -0.025,496 0.208,497 -0.148,498 0.119,499 0.031,500 -0.091,501 0.046,502 -0.001,503 -0.021,504 0.011,505 0.153,506 -0.092,507 0.041,508 -0.112,509 0.142,510 -0.077,511 -0.144,512 -0.049,513 -0.022,514 -0.006,515 -0.081,516 -0.054,517 -0.285,518 -0.182,519 -0.387,520 -0.332,521 -0.207,522 -0.374,523 0.038,524 -0.039,525 0.169,526 0.083,527 -0.008,528 0.18,529 -0.283,530 0.208,531 -0.46,532 -0.066,533 -0.27,534 -0.003,535 0.534,536 0.494,537 1.038,538 1.012,539 0.443,540 1.426,541 2.189,542 4.332,543 0.714,544 5.714,545 1.031,546 1.131,547 1.292,548 1.671,549 0.688,550 2.773,551 3.135,552 3.434,553 3.664,554 3.829,555 3.784,556 3.584,557 3.466,558 3.296,559 2.639,560 3.214,561 0.67,562 212.65,563 2.773,564 4.317,565 5.187,566 6.084,567 6.971,568 7.872,569 8.761,570 9.664,571 10.554,572 11.456,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,596 1,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,612 9,613 4,614 3,615 5,616 1,617 2,619 2,620 2,621 1,625 1,626 1,627 1,629 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.056,648 1.217,649 1.384,650 1.241,651 0.927,652 2.286,653 7.137,654 2.996,655 3.57,656 4.107,657 4.573,658 5.037,659 5.098,660 5.174,661 5.3,662 5.332,663 4.676,664 0.5,665 24,666 5.164,667 0.002,668 2.296,669 8.258,670 9.389,671 0.001,672 7.798,673 -0.001,674 2.758,675 38.611,676 0.002,677 70.627,678 45.111,679 32.897,680 39.149,681 67.951,683 45.111,684 177.726,685 32.897,687 35.432,688 71.234,689 29.85,690 9.443,692 70.627,693 39.149,694 70.627,695 78.008,696 67.951,697 39.149,698 47.084,699 48.687,700 42.806,701 35.432,702 42.576,703 39.149,704 70.627,705 100.848,706 84.259,707 70.627,708 16.682,709 28.429,710 139.996,711 70.627,712 100.848,713 84.259,714 0.601,715 0.374,716 0.195,717 0.098,718 12,719 6,722 1,723 1.2,724 2.463,725 92.249,726 0.2,727 10,728 53.303,729 9.614,730 3.329,731 1.459,732 100.848,733 5.169,734 1.484,735 75.703,736 255.734,737 19,738 11.332,740 -0.523,741 23.716,742 26.02,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.313,751 5.22,752 -0.243,753 3.807,754 4.248,755 2.543,756 6.098,757 3.723,758 5.473,759 -0.912,760 6.838,761 -0.699,762 3.611,763 4.182,764 2.078,765 7.149,766 3.451,767 6.797,768 -1.297,769 8.558,770 -2.303,771 5.468,772 6.392,773 3.726,774 10.288,775 5.316,776 8.156,777 -1.373,778 10.333,779 -3.328,780 6.043,781 7.091,782 3.934,783 12.128,784 5.824,785 9.546,786 -1.528,787 12.142,788 -3.434,789 7.446,790 8.85,791 5.161,792 14.819,793 7.222,794 10.958,795 -1.766,796 13.975,797 -4.611,798 8.36,799 9.901,800 5.695,801 16.991,802 8.077,803 12.388,804 -2,805 15.825,806 -5.426,807 9.604,808 11.478,809 6.718,810 19.52,811 9.303,812 3.234,813 -2,814 17.689,815 -6.668,816 10.664,817 12.701,818 7.405,819 21.836,820 10.312,821 2.548,822 11.294,823 19.563,824 -7.519,825 11.855,826 14.196,827 8.33,828 24.302,829 11.475,830 2.078,831 8.069,832 21.445,833 4.088,834 12.977,835 15.506,836 9.089,837 26.678,838 12.551,839 1.733,840 6.224,841 23.335,842 3.099,843 14.151,844 16.959,845 9.966,846 29.119,847 13.691,848 1.262,849 4.771,850 25.23,851 2.556,852 15.301,853 18.315,854 10.76,855 31.523,856 14.798,857 0.425,858 2.912,859 27.131,860 2.126,861 16.47,862 19.747,863 11.613,864 33.953,865 15.931,866 -0.092,867 0.961,868 29.035,869 1.634,870 17.632,871 21.126,872 12.425,873 36.368,874 17.052,875 1163,876 2380,877 9.364,878 15.824,879 23.134,880 25.903,881 24.452,882 22.804,883 22.559,884 28.103,885 7.256,886 68.464,887 21.474,888 5.446,889 6.336,890 6.402,891 5.237,892 5.234,893 7.088,894 3.935,895 18.813,896 5.111,897 7.77,898 1.542,899 1.727,900 1.63,901 1.52,902 1.504,903 1.874,904 0.484,905 4.564,906 1.432,907 3.996,908 4.022,909 4.054,910 3.915,911 7.429,912 3.916,913 3.562,914 3.604,915 3.598,916 3.398,917 6.465,918 3.409,919 3.136,920 3.187,921 3.274,922 2.913,923 4.995,924 2.924,925 2.89,926 2.983,927 2.934,928 2.679,929 4.89,930 2.684,931 2.75,932 2.774,933 2.735,934 2.513,935 4.32,936 2.541,937 2.518,938 2.597,939 2.362,940 2.067,941 3.739,942 2.078,943 2.293,944 2.365,945 2.11,946 1.784,947 3.225,948 1.864,949 1.707,950 1.868,951 2.008,952 1.424,953 3.018,954 1.355,955 0.3,956 0.289,957 0.458,958 0.28,959 0.216,960 4.5,961 0.273,962 4.336,963 0.153,964 6.865,965 0.753,966 4.197,967 0.207,968 3.234,969 4.088,970 2.291,971 11.294,972 3.111,973 1.949,974 1.927,975 2.036,976 2.06,977 1.264,978 2.055,979 1.507,980 1.464,981 1.685,982 1.701,983 0.831,984 1.701,985 1.005,986 0.968,987 1.189,988 1.349,989 0.239,990 1.286,991 0.839,992 0.762,993 1.113,994 1.144,995 0.119,996 1.17,997 0.651,998 0.61,999 0.9,1000 0.87,1002 0.895,1003 0.405,1004 0.271,1005 0.757,1006 0.834,1008 0.794,1009 0.114,1010 0.051,1011 0.583,1012 0.608,1014 0.62,1017 0.314,1018 0.182,1020 0.242,1021 3.434,1022 4.779,1023 6.347,1024 8.022,1025 9.749,1027 5.855,1029 5.539,1030 9.5,1031 0.409,1033 -0.689,1034 0.534,1036 15.407,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 27.699,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.979,1049 3,1050 2.322,1051 21.072,1052 28,1053 20,1054 0.427,1055 100.519,1056 172.87,1057 237.027,1058 1663,1059 4.3,1060 10.293,1061 0.735,1062 0.574,1063 10.793,1064 8.03,1065 6.609,1066 0.441,1067 0.303,1068 4.138,1069 6.063,1070 4.042,1071 3.312,1072 6.898,1073 4.546,1074 6.177,1075 0.281,1076 0.164,1077 6.548,1078 3.615,1079 5.444,1080 0.181,1081 0.085,1082 5.781,1083 2.553,1084 4.335,1085 0.114,1086 0.048,1087 4.725,1088 1.828,1089 3.154,1090 0.07,1091 0.026,1092 3.388,1093 1.156,1094 0.601,1095 44.895,1096 0.327,1097 13.486,1098 1.398,1099 74,1100 251.046,1101 97.279,1102 271.568,1103 349.81,1104 248,1105 89,1106 231.765,1107 110.209,1108 240.79,1109 353.61,1110 226,1111 5}
{0 CHEMBL2047859,1 1.614,2 5.071,3 0.435,4 0.189,5 52.435,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.578,13 2.862,14 3.87,15 4.036,16 3.297,17 3.275,18 4.983,19 3.246,20 4.165,21 4.34,22 3.463,23 3.412,24 5.538,25 3.378,26 4.246,27 4.464,28 3.243,29 3.306,30 5.504,31 3.25,32 4.073,33 4.294,34 2.732,35 3.045,36 5.296,37 2.919,38 3.805,39 4.145,40 1.888,41 2.475,42 4.782,43 2.232,44 2.809,45 3.167,46 0.637,47 1.539,48 3.664,49 1.26,50 2.091,51 2.539,52 0.055,53 0.77,54 2.197,55 0.441,56 0.105,57 0.382,58 5.588,59 2.265,60 12.399,61 3.008,62 0.123,63 0.599,64 9.672,65 3.839,66 16.652,67 5.304,68 0.297,69 0.734,70 13.743,71 4.815,72 57.627,73 6.68,74 0.361,75 0.696,76 16.309,77 4.63,78 53.771,79 6.579,80 0.298,81 0.534,82 13.973,83 4.231,84 49.815,85 5.82,86 0.265,87 0.338,88 12.227,89 3.094,90 49.073,91 4.937,92 0.099,93 0.128,94 4.347,95 0.927,96 17.541,97 1.661,98 0.038,99 0.043,100 2.26,101 0.552,102 5.991,103 1.014,104 17,105 22,106 0.326,107 0.723,108 0.828,109 0.865,110 0.881,111 0.881,112 2.737,113 0.896,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,119 1,123 1,128 3,129 2,130 1,135 1,137 6,139 1,140 2,142 1,143 6,144 1,146 5,148 2,149 3,150 3,151 6,153 1,155 3,158 1,159 5,160 1,161 3,163 1,165 3,168 3,171 2,173 1,177 2,179 2,194 140,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 9.87,202 5.096,203 9.132,204 7.326,205 7.326,206 7.326,207 7.326,208 7.326,209 5.915,210 8.64,211 2.358,212 7.427,213 3.086,214 1.116,215 0.597,216 0.414,217 0.337,218 0.337,219 3.369,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 19.117,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 71,235 4.5,236 4.333,237 6.865,238 4.212,239 3.234,240 4.088,241 2.291,242 11.294,243 3.159,244 3.845,245 3.335,246 5.979,247 3.55,248 2.548,249 3.099,250 1.257,251 8.069,252 2.546,253 3.326,254 2.983,255 5.233,256 3.062,257 2.078,258 2.556,259 0.08,260 6.224,261 2.044,262 2.989,263 2.325,264 4.774,265 2.713,266 1.733,267 2.126,269 4.771,270 1.695,271 2.622,272 1.807,273 3.829,274 2.261,275 1.262,276 1.634,278 2.912,279 1.258,280 1.884,281 1.405,282 3.146,283 1.478,284 0.425,285 0.549,286 0.961,287 0.441,288 1.083,289 0.752,290 2.844,291 0.888,292 -0.092,293 -0.101,294 -0.243,295 -0.09,296 1,297 -0.01,298 2.347,299 0.687,300 -0.313,301 -0.387,302 -0.699,303 -0.313,304 0.361,305 -0.106,306 1.866,307 0.066,308 -0.912,309 -1.072,310 -2.303,311 -0.888,313 -0.693,314 1.728,315 -0.253,316 -1.297,317 -1.513,318 -3.328,319 -1.341,320 -0.1,321 -0.877,322 1.37,323 -0.378,324 -1.373,325 -1.767,326 -3.434,327 -1.361,328 -0.454,329 -1.231,330 1.267,331 -0.56,332 -1.528,333 -1.836,335 -4.611,336 -1.497,337 -0.5,338 -1.513,339 1.205,340 -0.789,341 -1.766,342 -2.169,343 -0.67,344 -5.426,345 -1.705,346 -0.611,347 -1.671,348 1.083,349 -1,350 -2,351 -2.205,352 -1.313,353 -6.668,354 -1.948,355 -0.946,356 -2,357 0.464,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.519,363 -2,364 6.467,365 0.462,366 0.477,367 0.034,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.758,375 0.697,376 15.733,377 0.605,378 10.598,379 0.757,380 3.392,381 0.242,382 3.217,383 0.23,384 0.242,386 0.448,389 0.743,390 1.071,391 0.831,392 0.922,393 0.818,394 0.893,395 0.565,396 1.164,397 0.715,398 1.034,399 0.595,400 0.921,401 0.726,402 1.231,403 0.896,404 1.204,405 0.746,406 1.103,407 1.34,408 0.979,409 1.164,410 1.014,411 1.206,412 1.037,413 1.513,414 1.15,415 1.425,416 1.278,417 1.41,418 1.343,419 1.043,420 0.671,421 0.887,422 0.674,423 1.222,424 0.751,425 0.909,426 0.512,427 1.154,428 0.64,429 1.03,430 0.866,437 3,439 2.222,440 1.625,441 1.209,442 0.347,443 0.08,447 1073,448 3253,449 1.952,450 46.2,451 3,452 4,454 3,455 2,456 1.518,457 1.75,458 2.405,459 1.383,462 41.973,463 1.614,464 3.584,465 4.104,466 4.287,467 4.364,468 4.364,469 1.577,470 3.039,471 3.787,472 2.386,473 217.116,474 6.352,475 1689.57,476 122.211,477 1.557,478 3.689,479 0.2,481 0.101,482 0.068,483 0.067,484 0.039,485 0.027,489 0.501,490 0.67,491 0.788,492 50.723,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.136,498 0.097,499 0.086,500 -0.012,501 0.135,502 0.048,504 0.093,505 0.2,506 -0.152,507 0.013,508 -0.193,509 0.18,510 -0.141,511 -0.177,512 -0.005,513 -0.178,514 -0.095,515 -0.068,516 -0.124,517 -0.29,518 -0.278,519 -0.434,520 -0.338,521 -0.215,522 -0.41,523 -0.057,524 -0.004,525 0.193,526 0.182,527 -0.074,528 0.225,529 -0.144,530 0.264,531 -0.098,532 0.133,533 -0.199,534 0.061,535 0.406,536 0.458,537 1.13,538 0.826,539 0.338,540 1.089,541 2.105,542 4.391,543 0.714,544 5.714,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.135,552 3.434,553 3.664,554 3.829,555 3.784,556 3.584,557 3.466,558 3.296,559 2.639,560 3.214,561 0.619,562 192.24,563 2.773,564 4.317,565 5.187,566 6.084,567 6.971,568 7.872,569 8.761,570 9.664,571 10.554,572 11.456,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 15,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,633 1,635 1,636 1,639 7.7,640 1,642 1,645 8,646 4.733,647 3.056,648 1.432,649 1.384,650 1.241,651 0.922,652 2.114,653 7.137,654 2.996,655 3.57,656 4.107,657 4.573,658 5.037,659 5.098,660 5.174,661 5.3,662 5.332,663 4.676,664 0.5,665 24,666 5.18,667 0.002,668 2.267,669 8.107,670 9.603,671 0.001,672 7.963,673 -0.001,674 2.607,675 36.5,676 0.003,677 105.94,678 53.621,679 32.897,681 67.951,683 53.621,684 173.891,685 32.897,686 8.825,687 35.432,688 71.234,689 29.85,690 9.128,692 105.94,694 105.94,695 86.518,696 67.951,698 82.398,699 48.687,700 42.806,701 44.257,702 42.261,704 105.94,705 100.848,706 53.621,707 105.94,708 16.367,709 37.254,710 100.848,711 105.94,712 100.848,713 53.621,714 0.601,715 0.374,716 0.195,717 0.098,718 12,719 6,722 1,723 1.2,724 2.463,725 92.249,726 0.2,727 10,728 51.303,729 9.339,730 3.17,731 1.372,732 100.848,733 5.62,734 2.379,735 75.703,736 260.409,737 19,738 11.391,740 -0.438,741 26.276,742 29.491,743 0.343,744 0.763,745 0.873,746 0.912,747 0.928,748 0.928,749 4.256,750 -0.313,751 5.22,752 -0.243,753 3.807,754 4.248,755 2.543,756 6.098,757 3.779,758 5.473,759 -0.912,760 6.838,761 -0.699,762 3.611,763 4.182,764 2.078,765 7.149,766 3.559,767 6.797,768 -1.297,769 8.558,770 -2.303,771 5.468,772 6.392,773 3.726,774 10.288,775 5.403,776 8.156,777 -1.373,778 10.333,779 -3.328,780 6.043,781 7.091,782 3.934,783 12.128,784 5.95,785 9.546,786 -1.528,787 12.142,788 -3.434,789 7.446,790 8.85,791 5.161,792 14.819,793 7.336,794 10.958,795 -1.766,796 13.975,797 -4.611,798 8.36,799 9.901,800 5.695,801 16.991,802 8.221,803 12.388,804 -2,805 15.825,806 -5.426,807 9.604,808 11.478,809 6.718,810 19.52,811 9.445,812 3.234,813 -2,814 17.689,815 -6.668,816 10.664,817 12.701,818 7.405,819 21.836,820 10.476,821 2.548,822 11.294,823 19.563,824 -7.519,825 11.855,826 14.196,827 8.33,828 24.302,829 11.643,830 2.078,831 8.069,832 21.445,833 4.088,834 12.977,835 15.506,836 9.089,837 26.678,838 12.738,839 1.733,840 6.224,841 23.335,842 3.099,843 14.151,844 16.959,845 9.966,846 29.119,847 13.888,848 1.262,849 4.771,850 25.23,851 2.556,852 15.301,853 18.315,854 10.76,855 31.523,856 15.01,857 0.425,858 2.912,859 27.131,860 2.126,861 16.47,862 19.747,863 11.613,864 33.953,865 16.155,866 -0.092,867 0.961,868 29.035,869 1.634,870 17.632,871 21.126,872 12.425,873 36.368,874 17.291,875 1163,876 2080,877 9.364,878 16.727,879 23.134,880 25.631,881 24.452,882 22.635,883 22.559,884 28.103,885 7.256,886 68.464,887 22.287,888 5.446,889 6.333,890 6.402,891 5.251,892 5.234,893 7.088,894 3.935,895 18.813,896 5.159,897 7.77,898 1.542,899 1.709,900 1.63,901 1.509,902 1.504,903 1.874,904 0.484,905 4.564,906 1.486,907 4.009,908 4.038,909 3.958,910 3.926,911 7.429,912 3.928,913 3.581,914 3.63,915 3.495,916 3.413,917 6.465,918 3.424,919 3.217,920 3.282,921 3.082,922 3.047,923 4.987,924 3.04,925 3.021,926 3.111,927 2.834,928 2.692,929 4.684,930 2.699,931 2.867,932 2.948,933 2.729,934 2.636,935 3.9,936 2.675,937 2.545,938 2.608,939 2.35,940 2.206,941 3.733,942 2.192,943 2.399,944 2.507,945 2.109,946 2.067,947 3.168,948 2.074,949 2.263,950 2.33,951 2.011,952 1.728,953 3.018,954 1.818,955 0.3,956 0.289,957 0.458,958 0.281,959 0.216,960 4.5,961 0.273,962 4.333,963 0.153,964 6.865,965 0.753,966 4.212,967 0.211,968 3.234,969 4.088,970 2.291,971 11.294,972 3.159,973 1.971,974 1.946,975 2.076,976 2.081,977 1.288,978 2.078,979 1.537,980 1.489,981 1.744,982 1.739,983 0.917,984 1.742,985 1.21,986 1.142,987 1.52,988 1.428,989 0.573,990 1.46,991 0.868,992 0.807,993 1.172,994 1.309,995 0.193,996 1.251,997 0.838,998 0.756,999 1.076,1000 1.12,1001 0.055,1002 1.15,1003 0.435,1004 0.349,1005 0.86,1006 0.84,1008 0.8,1009 0.401,1010 0.271,1011 0.722,1012 0.701,1014 0.739,1015 0.088,1016 0.02,1017 0.566,1018 0.565,1020 0.577,1021 3.434,1022 4.779,1023 6.347,1024 8.022,1025 9.749,1026 1.853,1029 5.582,1030 9.585,1031 0.493,1033 -0.63,1034 0.666,1036 16.106,1037 41.973,1038 93.192,1039 106.702,1040 111.457,1041 113.457,1042 113.457,1043 25.833,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.979,1049 3,1050 2.322,1051 21.072,1052 28,1053 20,1054 0.427,1055 101.779,1056 174.96,1057 240.1,1058 1663,1060 10.293,1061 0.735,1062 0.564,1063 10.293,1064 7.897,1065 6.609,1066 0.441,1067 0.299,1068 4.419,1069 6.353,1070 4.287,1071 3.565,1072 6.609,1073 4.479,1074 6.177,1075 0.281,1076 0.161,1077 6.177,1078 3.543,1079 5.444,1080 0.181,1081 0.083,1082 5.444,1083 2.499,1084 4.335,1085 0.114,1086 0.047,1087 4.335,1088 1.779,1089 3.154,1090 0.07,1091 0.025,1092 3.154,1093 1.13,1094 0.601,1095 41.72,1096 0.327,1097 13.486,1098 1.398,1099 74,1100 224.843,1101 81.76,1102 218.185,1103 290.89,1104 200,1105 89,1106 214.902,1107 98.174,1108 215.666,1109 314.97,1110 202,1111 5}
{0 CHEMBL2047860,1 1.989,2 5.588,3 0.891,4 0.794,5 53.368,6 9.47,7 0.333,8 3.427,9 3.53,10 3.133,11 2.862,12 4.788,13 2.925,14 3.974,15 4.101,16 3.664,17 3.263,18 5.906,19 3.329,20 4.211,21 4.366,22 3.711,23 3.399,24 5.788,25 3.453,26 4.333,27 4.515,28 3.694,29 3.285,30 5.931,31 3.376,32 4.202,33 4.367,34 3.561,35 3.01,36 6.1,37 3.14,38 3.995,39 4.253,40 2.923,41 2.427,42 5.926,43 2.526,44 2.987,45 3.269,46 2.016,47 1.498,48 4.959,49 1.548,50 2.397,51 2.717,52 0.595,53 0.701,54 3.932,55 0.77,56 0.299,57 0.612,58 3.321,59 2.361,60 60.194,61 2.169,62 0.877,63 1.223,64 7.535,65 4.029,66 164.651,67 3.984,68 0.787,69 1.017,70 10.406,71 4.935,72 143.458,73 5.461,74 1.135,75 1.042,76 14.979,77 4.751,78 193.671,79 4.927,80 1.253,81 0.955,82 13.148,83 4.442,84 224.104,85 3.981,86 1.37,87 0.509,88 16.994,89 3.266,90 267.608,91 3.255,92 0.398,93 0.203,94 5.807,95 0.936,96 75.11,97 1.263,98 0.328,99 0.079,100 4.346,101 0.618,102 58.244,103 0.361,104 38,105 28,106 0.401,107 0.77,108 0.828,109 0.865,110 0.881,111 0.881,112 2.911,113 0.799,114 -2.96,115 -2.96,116 -2.86,117 38.5,119 1,123 1,125 1,128 3,129 2,130 1,135 1,137 5,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 4,153 1,155 3,158 1,159 4,160 1,161 1,163 1,165 2,168 3,171 2,173 1,177 1,179 1,194 275,195 10.524,196 10.524,197 10.524,198 10.524,199 10.524,200 9.73,201 11.899,202 5.793,203 10.855,204 8.82,205 8.82,206 8.82,207 8.82,208 8.82,209 7.462,210 11.205,211 2.695,212 9.403,213 2.712,214 0.885,215 0.597,216 0.414,217 0.337,218 0.337,219 3.546,221 191,222 3,223 73.959,224 63.825,226 0.907,227 46.576,228 0.83,229 1,230 0.8,231 0.5,232 0.88,233 41.5,234 95,235 4.655,236 4.494,237 7.346,238 4.369,239 3.452,240 4.196,241 3.825,242 12.762,243 3.225,244 4.142,245 4.301,246 6.609,247 3.936,248 3.02,249 3.295,250 2.291,251 10.218,252 2.742,253 3.701,254 3.327,255 5.862,256 3.362,257 2.39,258 2.957,259 1.257,260 7.732,261 2.277,262 3.139,263 2.884,264 5.202,265 2.985,266 2.026,267 2.221,268 0.08,269 6.082,270 1.922,271 2.898,272 2.116,273 4.566,274 2.455,275 1.487,276 2.047,278 4.148,279 1.423,280 2.508,281 1.7,282 3.831,283 2.151,284 1.178,285 1.494,286 2.889,287 1.128,288 1.854,289 1.405,290 3.152,291 1.449,292 0.395,293 0.51,294 0.901,295 0.41,296 1.083,297 0.626,298 3.033,299 0.863,300 -0.116,301 -0.13,302 -0.303,303 -0.113,304 0.783,305 0.51,306 2.56,307 0.405,308 -0.57,309 -0.706,310 -1.534,311 -0.553,312 0.34,313 0.51,314 2.24,315 0.042,316 -0.934,317 -1,318 -2.353,319 -0.7,321 -0.074,322 2,323 -0.253,324 -1,325 -1,326 -3,327 -0.7,329 -0.233,330 2,331 -0.3,332 -1,333 -1.113,335 -3,336 -0.908,338 -0.763,339 1.731,340 -0.3,341 -1.299,342 -1.555,343 -0.67,344 -3.343,345 -1.349,346 -0.428,347 -0.88,348 1.719,349 -0.555,350 -1.516,351 -1.79,352 -0.805,353 -4.593,354 -1.462,355 -0.5,356 -1.347,357 1.363,358 -0.671,359 -1.648,360 -1.983,361 -1.313,362 -5.351,363 -1.609,364 7.324,365 0.431,366 0.766,367 0.045,368 19,369 1.118,370 8,371 0.471,372 11,373 0.647,374 12.617,375 0.742,376 20.276,377 0.78,378 15.763,379 0.927,380 4.031,381 0.237,382 3.789,383 0.223,384 0.263,385 0.068,386 0.396,387 3,389 0.643,390 0.898,391 0.613,392 0.927,393 0.713,394 0.817,395 0.427,396 0.742,397 0.552,398 1.014,399 0.437,400 0.942,401 0.596,402 0.908,403 0.679,404 1.19,405 0.582,406 1.087,407 1.025,408 0.906,409 1.004,410 1.016,411 1.052,412 1.007,413 1.209,414 1.341,415 1.141,416 1.294,417 1.171,418 1.228,419 1.586,420 1.181,421 1.508,422 0.683,423 1.585,424 0.865,425 1.246,426 0.743,427 1.357,428 0.649,429 1.237,430 0.932,431 3.123,432 1.422,433 2.739,434 0.016,435 3.004,436 0.53,437 5,439 2.889,440 2.125,441 1.827,442 0.785,443 0.322,447 1748,448 8812,449 1.882,450 34.6,452 4,454 3,455 2,456 1.581,457 1.659,458 2.529,459 1.366,461 1,462 51.708,463 1.989,464 3.815,465 4.104,466 4.287,467 4.364,468 4.364,469 1.971,470 3.22,471 4.065,472 2.596,473 353.119,474 6.924,475 3129.73,476 122.211,477 1.792,478 3.933,479 0.278,481 0.103,482 0.071,483 0.068,484 0.037,485 0.036,489 0.593,490 0.67,491 1.011,492 67.28,493 -0.059,494 0.022,495 -0.037,496 0.167,497 -0.132,498 0.121,499 0.358,500 0.317,501 0.169,502 0.073,503 0.343,504 0.006,505 0.047,506 -0.154,507 0.099,508 -0.198,509 0.065,510 -0.087,511 -0.135,512 -0.069,513 -0.063,514 -0.106,515 -0.159,516 -0.065,517 -0.094,518 -0.347,519 -0.125,520 -0.35,521 -0.075,522 -0.307,523 -0.186,524 -0.061,525 -0.145,526 0.19,527 -0.155,528 0.132,529 0.027,530 0.333,531 -0.008,532 0.137,533 0.037,534 0.037,535 -1.082,536 0.337,537 -0.999,538 0.88,539 -1.008,540 0.452,541 5.881,542 4.693,543 0.588,544 7.834,545 1.07,546 1.173,547 1.726,548 2.978,549 0.636,550 2.944,551 3.367,552 3.611,553 3.871,554 4.111,555 4.078,556 4.043,557 3.85,558 3.807,559 3.367,560 3.666,561 0.664,562 246.21,563 2.944,564 4.533,565 5.398,566 6.326,567 7.219,568 8.145,569 9.047,570 9.969,571 10.875,572 11.796,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 18,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,600 1,601 2,602 7,603 3,605 1,606 1,608 1,610 1,611 3,612 9,613 7,614 3,615 7,617 2,619 2,620 2,621 1,625 1,626 1,627 1,630 3,631 17,632 1,633 1,635 1,636 1,637 1,638 3,639 7.7,640 1,642 1,645 10.25,646 4.412,647 3.556,648 1.351,649 1.392,650 1.227,651 0.925,652 2.7,653 7.514,654 3.135,655 3.726,656 4.245,657 4.744,658 5.247,659 5.368,660 5.56,661 5.573,662 5.691,663 5.444,664 0.75,665 30,666 6.88,668 3.671,669 9.015,670 10.851,672 9.057,674 3.515,675 59.75,677 70.627,678 52.555,679 32.897,681 67.951,682 44.88,683 52.555,684 138.577,685 77.778,687 35.432,688 71.234,689 29.85,690 54.008,692 70.627,693 7.76,694 70.627,695 85.453,696 112.831,698 47.084,699 93.567,700 42.806,701 43.191,702 42.261,704 115.507,705 100.848,706 52.555,707 78.386,708 16.367,709 28.429,710 145.728,711 70.627,712 145.728,713 52.555,714 0.618,715 0.359,716 0.184,717 0.106,718 15,719 8,722 1,723 1.2,724 2.642,725 123.974,726 0.2,727 10,728 64.732,729 12.052,730 3.808,731 1.931,732 145.728,733 3.435,734 -1.362,735 75.703,736 268.91,737 22,738 11.351,740 -0.936,741 27.814,742 30.511,743 0.423,744 0.812,745 0.873,746 0.912,747 0.928,748 0.928,749 4.449,750 -0.116,751 5.501,752 0.901,753 4.043,754 4.407,755 3.483,756 6.447,757 3.93,758 5.708,759 -0.57,760 7.169,761 -0.303,762 4.111,763 4.494,764 4.035,765 7.808,766 3.829,767 7.068,768 -0.934,769 8.948,770 -1.534,771 5.844,772 6.575,773 5.585,774 10.868,775 5.593,776 8.462,777 -1,778 10.787,779 -2.353,780 6.621,781 7.377,782 6.75,783 12.946,784 6.212,785 9.885,786 -1,787 12.662,788 -3,789 7.983,790 9.07,791 8.111,792 15.643,793 7.569,794 11.329,795 -1.299,796 14.561,797 -3,798 9.029,799 10.188,800 9.413,801 17.992,802 8.493,803 12.789,804 -1.516,805 16.476,806 -3.343,807 10.283,808 11.734,809 10.752,810 20.577,811 9.71,812 3.452,813 -1.648,814 18.405,815 -4.593,816 11.432,817 13.005,818 12.084,819 23.036,820 10.765,821 3.02,822 12.762,823 20.344,824 -5.351,825 12.656,826 14.49,827 13.423,828 25.586,829 11.936,830 2.39,831 10.218,832 22.29,833 4.196,834 13.847,835 15.838,836 14.761,837 28.091,838 13.048,839 2.026,840 7.732,841 24.243,842 3.295,843 15.065,844 17.294,845 16.102,846 30.631,847 14.206,848 1.487,849 6.082,850 26.202,851 2.957,852 16.275,853 18.682,854 17.442,855 33.157,856 15.344,857 1.178,858 4.148,859 28.165,860 2.221,861 17.495,862 20.126,863 18.784,864 35.696,865 16.502,866 0.395,867 2.889,868 30.132,869 2.047,870 18.714,871 21.535,872 20.125,873 38.231,874 17.653,875 1898,876 4336,877 10.751,878 16.54,879 28.681,880 30.054,881 29.581,882 28.19,883 27.895,884 33.44,885 14.906,886 89.464,887 26.255,888 5.602,889 6.494,890 6.86,891 5.409,892 5.452,893 7.196,894 5.47,895 20.642,896 5.225,897 11.063,898 1.593,899 1.67,900 1.643,901 1.566,902 1.55,903 1.858,904 0.828,905 4.97,906 1.459,907 4.018,908 4.045,909 3.983,910 3.925,911 8.513,912 3.933,913 3.602,914 3.646,915 3.553,916 3.412,917 7.999,918 3.431,919 3.314,920 3.357,921 3.301,922 3.04,923 7.999,924 3.087,925 3.069,926 3.137,927 2.969,928 2.69,929 7.429,930 2.726,931 2.872,932 2.956,933 2.738,934 2.632,935 6.465,936 2.681,937 2.561,938 2.613,939 2.433,940 2.197,941 4.987,942 2.248,943 2.446,944 2.538,945 2.25,946 2.067,947 4.638,948 2.075,949 2.274,950 2.338,951 2.019,952 1.727,953 3.746,954 1.824,955 0.259,956 0.25,957 0.408,958 0.243,959 0.192,960 4.655,961 0.233,962 4.494,963 0.213,964 7.346,965 0.709,966 4.369,967 0.179,968 3.452,969 4.196,970 3.825,971 12.762,972 3.225,973 1.965,974 1.942,975 2.054,976 2.082,977 1.279,978 2.071,979 1.526,980 1.482,981 1.702,982 1.743,983 0.866,984 1.725,985 1.131,986 1.096,987 1.246,988 1.443,989 0.314,990 1.369,991 0.839,992 0.784,993 1.148,994 1.315,995 0.153,996 1.227,997 0.823,998 0.751,999 0.988,1000 1.121,1002 1.136,1003 0.408,1004 0.299,1005 0.808,1006 0.84,1008 0.798,1009 0.356,1010 0.271,1011 0.634,1012 0.705,1014 0.712,1015 0.079,1016 0.014,1017 0.478,1018 0.568,1020 0.558,1021 3.611,1022 5.004,1023 6.597,1024 8.285,1025 10.025,1028 38.079,1029 5.41,1030 9.448,1031 -0.019,1033 -1.018,1034 -0.008,1035 -4.631,1036 17.256,1037 51.708,1038 99.192,1039 106.702,1040 111.457,1041 113.457,1042 113.457,1043 52.284,1044 6.122,1045 66.56,1046 66.56,1047 12,1048 12.306,1049 3,1050 2.322,1051 28.036,1052 37,1053 32,1054 0.405,1055 105.373,1056 193.17,1057 248.87,1058 2641,1059 11.5,1060 12.793,1061 0.753,1062 0.502,1063 10.293,1064 8.53,1065 7.82,1066 0.434,1067 0.266,1068 4.66,1069 7.268,1070 4.649,1071 3.772,1072 6.609,1073 4.796,1074 8.172,1075 0.292,1076 0.135,1077 6.177,1078 3.772,1079 6.22,1080 0.173,1081 0.072,1082 5.444,1083 2.603,1084 4.955,1085 0.105,1086 0.039,1087 4.335,1088 1.826,1089 4.09,1090 0.068,1091 0.021,1092 3.154,1093 1.237,1094 0.577,1095 51.238,1096 0.305,1097 16.218,1098 1.309,1099 92,1100 501.176,1101 116.777,1102 397.912,1103 498.43,1104 362,1105 110,1106 338.902,1107 129.65,1108 318.902,1109 488.4,1110 298,1111 5.167}
{0 CHEMBL2047861,1 1.869,2 5.357,3 0.613,4 0.376,5 52.199,6 9.246,7 0.4,8 3.285,9 3.388,10 3.003,11 2.821,12 4.551,13 2.821,14 3.761,15 3.889,16 3.423,17 3.233,18 4.991,19 3.214,20 4.09,21 4.25,22 3.545,23 3.351,24 5.548,25 3.318,26 4.077,27 4.269,28 3.303,29 3.143,30 5.434,31 3.097,32 3.797,33 4.006,34 3.062,35 2.827,36 5.177,37 2.747,38 3.377,39 3.633,40 2.501,41 2.311,42 4.715,43 2.134,44 2.418,45 2.711,46 1.611,47 1.362,48 3.608,49 1.156,50 1.219,51 1.33,52 0.403,53 0.664,54 2.222,55 0.454,56 0.142,57 0.334,58 3.482,59 1.88,60 16.362,61 2.121,62 0.189,63 0.519,64 6.349,65 3.316,66 22.002,67 3.951,68 0.438,69 0.627,70 13.164,71 4.613,72 68.601,73 5.477,74 0.508,75 0.544,76 14.465,77 4.286,78 67.775,79 4.936,80 0.418,81 0.373,82 12.01,83 3.511,84 58.031,85 4.035,86 0.32,87 0.199,88 13.091,89 2.604,90 44.396,91 3.25,92 0.123,93 0.06,94 5.414,95 0.94,96 17.987,97 1.321,98 0.042,99 0.003,100 2.992,101 0.338,102 4.368,103 0.342,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.908,114 -2.52,115 -2.55,116 -2.49,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 2,142 1,143 6,144 1,146 3,148 2,149 3,150 3,151 4,153 1,155 4,158 1,159 3,160 1,161 1,163 1,165 1,168 4,169 1,171 2,173 2,185 1,186 1,194 140,195 9,196 9,197 9,198 9,199 9,200 8.142,201 10.877,202 5.062,203 9.219,204 7.336,205 7.336,206 7.336,207 7.336,208 7.336,209 5.935,210 10.301,211 2.381,212 7.707,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,220 1,221 154,222 1.732,223 57.448,224 49.428,226 0.837,227 21.898,228 0.83,229 1,230 0.8,232 0.8,233 31.333,234 75,235 4.434,236 4.327,237 6.708,238 4.154,239 3.18,240 3.991,241 2.291,242 10.739,243 3.093,244 3.85,245 3.328,246 5.854,247 3.493,248 2.52,249 3.148,250 1.257,251 7.789,252 2.449,253 3.4,254 3.02,255 5.183,256 3,257 2.046,258 2.678,259 0.08,260 6.048,261 1.96,262 3.146,263 2.657,264 4.943,265 2.935,266 2.024,267 2.249,269 5.684,270 1.731,271 2.47,272 1.94,273 3.907,274 2.083,275 1.088,276 1.44,278 2.809,279 1.077,280 1.827,281 1.436,282 3.157,283 1.426,284 0.369,285 0.476,286 0.845,287 0.385,288 1.333,289 0.746,290 2.812,291 1.036,292 0.126,293 0.144,294 0.298,295 0.101,296 0.616,297 0.189,298 2.353,299 0.2,300 -0.659,301 -0.743,302 -1.627,303 -0.467,304 0.496,305 -0.206,306 1.867,307 0.178,308 -0.802,309 -1.006,310 -2.291,311 -0.787,313 -0.528,314 1.729,315 -0.246,316 -1.24,317 -1.475,318 -3.136,319 -1.068,320 -0.064,321 -0.919,322 1.384,323 -0.504,324 -1.346,325 -1.631,326 -3.466,327 -1.355,328 -0.455,329 -1.069,330 1.212,331 -0.562,332 -1.522,333 -1.845,335 -4.696,336 -1.479,337 -0.5,338 -1.534,339 1.118,340 -0.855,341 -1.784,342 -2.182,343 -0.67,344 -5.384,345 -1.694,346 -0.607,347 -1.668,348 1.077,349 -1,350 -2,351 -2.246,352 -1.313,353 -6.112,354 -1.947,355 -0.946,356 -2,357 0.695,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.502,363 -2,364 6.681,365 0.477,366 0.494,367 0.035,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 9.523,375 0.68,376 15.519,377 0.675,378 10.667,379 0.762,380 3.409,381 0.243,382 3.183,383 0.227,384 0.267,386 0.434,389 0.728,390 1.014,391 0.57,392 0.69,393 0.809,394 0.725,395 0.608,396 1.242,397 0.586,398 0.926,399 0.613,400 0.892,401 0.827,402 1.111,403 0.917,404 1.079,405 0.782,406 1.055,407 1.282,408 1.004,409 0.934,410 0.982,411 1.334,412 1.055,413 1.247,414 0.964,415 0.907,416 0.936,417 1.273,418 1.014,419 1.11,420 0.721,421 1.665,422 1.164,423 1.099,424 1.076,425 0.867,426 0.441,427 1.547,428 0.966,429 0.861,430 0.861,431 3.349,432 0.127,433 8.684,434 3.772,435 1.79,436 2.827,437 3.5,439 2.222,440 1.25,441 1.249,442 0.313,443 0.161,447 1105,448 4531,449 1.952,450 39.1,452 4,454 3,455 2,456 1.516,457 1.75,458 2.493,459 1.453,461 1,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.924,470 3.039,471 3.785,472 2.486,473 226.237,474 6.338,475 1730.17,476 104.042,477 1.557,478 3.689,479 0.233,481 0.101,482 0.054,483 0.078,484 0.031,485 0.04,489 0.538,490 0.67,491 0.788,492 51.071,493 -0.04,494 0.22,495 -0.025,496 0.208,497 -0.15,498 0.119,499 0.031,500 -0.091,501 0.046,502 -0.001,503 -0.007,504 0.011,505 0.068,506 -0.084,507 -0.084,508 -0.153,509 0.128,510 -0.141,511 -0.186,512 -0.079,513 -0.095,514 -0.083,515 -0.163,516 -0.136,517 -0.113,518 -0.131,519 0.072,520 0.014,521 -0.119,522 -0.033,523 0.004,524 -0.029,525 -0.059,526 -0.078,527 -0.017,528 0.041,529 0.189,530 0.168,531 0.225,532 0.159,533 0.119,534 0.35,535 -1.399,536 0.131,537 -3.304,538 -1.813,539 -0.844,540 -1.477,541 2.167,542 4.307,543 0.714,544 6,545 1.031,546 1.131,547 1.292,548 1.671,549 0.688,550 2.773,551 3.135,552 3.401,553 3.611,554 3.85,555 3.784,556 3.664,557 3.497,558 3.332,559 2.398,560 3.33,561 0.67,562 212.65,563 2.773,564 4.317,565 5.176,566 6.066,567 6.946,568 7.838,569 8.724,570 9.615,571 10.503,572 11.395,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,596 1,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,612 9,613 4,614 3,615 5,616 1,617 2,619 2,620 2,621 1,625 1,626 1,627 1,629 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.028,648 1.21,649 1.371,650 1.238,651 0.927,652 2.286,653 7.123,654 2.996,655 3.57,656 4.082,657 4.542,658 5.065,659 5.134,660 5.214,661 5.339,662 5.243,663 4.467,664 0.75,665 23,666 5.159,667 0.002,668 2.286,669 8.258,670 9.389,671 0.001,672 7.793,673 -0.001,674 2.758,675 38.611,676 0.002,677 70.627,678 45.111,679 32.897,680 39.149,681 67.951,683 45.111,684 177.726,685 32.897,687 35.432,688 71.234,689 29.85,690 9.443,692 70.627,693 39.149,694 70.627,695 78.008,696 67.951,697 39.149,698 47.084,699 48.687,700 42.806,701 35.432,702 42.576,703 39.149,704 70.627,705 100.848,706 84.259,707 70.627,708 16.682,709 28.429,710 139.996,711 70.627,712 100.848,713 84.259,714 0.603,715 0.362,716 0.181,717 0.104,718 12,719 6,722 1,723 1.2,724 2.485,725 91.367,726 0.2,727 10,728 53.303,729 9.614,730 3.329,731 1.565,732 100.848,733 5.005,734 1.722,735 75.703,736 255.734,737 19,738 11.307,740 -0.5,741 23.716,742 26.02,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.659,751 5.209,752 0.298,753 3.807,754 4.248,755 2.543,756 6.061,757 3.723,758 5.473,759 -0.802,760 6.812,761 -1.627,762 3.611,763 4.182,764 2.078,765 7.04,766 3.451,767 6.793,768 -1.24,769 8.512,770 -2.291,771 5.451,772 6.377,773 3.726,774 10.15,775 5.309,776 8.143,777 -1.346,778 10.264,779 -3.136,780 5.994,781 7.034,782 3.934,783 11.89,784 5.802,785 9.52,786 -1.522,787 12.047,788 -3.466,789 7.388,790 8.789,791 5.161,792 14.562,793 7.199,794 10.918,795 -1.784,796 13.853,797 -4.696,798 8.263,799 9.78,800 5.695,801 16.64,802 8.039,803 12.331,804 -2,805 15.676,806 -5.384,807 9.498,808 11.354,809 6.718,810 19.145,811 9.263,812 3.18,813 -2,814 17.512,815 -6.112,816 10.526,817 12.519,818 7.405,819 21.381,820 10.261,821 2.52,822 10.739,823 19.359,824 -7.502,825 11.703,826 14.006,827 8.33,828 23.814,829 11.42,830 2.046,831 7.789,832 21.214,833 3.991,834 12.8,835 15.266,836 9.089,837 26.123,838 12.489,839 2.024,840 6.048,841 23.077,842 3.148,843 13.958,844 16.707,845 9.966,846 28.524,847 13.625,848 1.088,849 5.684,850 24.946,851 2.678,852 15.087,853 18.02,854 10.76,855 30.867,856 14.725,857 0.369,858 2.809,859 26.821,860 2.249,861 16.24,862 19.436,863 11.613,864 33.253,865 15.853,866 0.126,867 0.845,868 28.699,869 1.44,870 17.383,871 20.779,872 12.425,873 35.612,874 16.968,875 1192,876 2465,877 9.364,878 15.824,879 23.186,880 25.836,881 24.306,882 22.908,883 22.703,884 28.254,885 7.256,886 68.427,887 21.592,888 5.379,889 6.327,890 6.013,891 5.193,892 5.18,893 6.991,894 3.935,895 18.241,896 5.093,897 7.9,898 1.546,899 1.722,900 1.62,901 1.527,902 1.514,903 1.884,904 0.484,905 4.562,906 1.439,907 3.995,908 4.022,909 4.04,910 3.914,911 7.429,912 3.914,913 3.565,914 3.604,915 3.658,916 3.407,917 6.465,918 3.416,919 3.132,920 3.187,921 3.19,922 2.884,923 4.995,924 2.903,925 2.904,926 2.981,927 3.007,928 2.713,929 4.904,930 2.718,931 2.725,932 2.778,933 2.602,934 2.487,935 4.282,936 2.508,937 2.52,938 2.595,939 2.406,940 2.092,941 3.648,942 2.096,943 2.308,944 2.363,945 2.287,946 1.772,947 3.462,948 1.865,949 1.704,950 1.868,951 1.868,952 1.415,953 2.806,954 1.329,955 0.296,956 0.288,957 0.447,958 0.277,959 0.212,960 4.434,961 0.266,962 4.327,963 0.153,964 6.708,965 0.716,966 4.154,967 0.206,968 3.18,969 3.991,970 2.291,971 10.739,972 3.093,973 1.95,974 1.927,975 2.037,976 2.062,977 1.263,978 2.057,979 1.504,980 1.465,981 1.667,982 1.693,983 0.828,984 1.693,985 1.014,986 0.967,987 1.214,988 1.353,989 0.268,990 1.295,991 0.827,992 0.764,993 1.13,994 1.13,995 0.13,996 1.154,997 0.666,998 0.608,999 0.93,1000 0.932,1002 0.955,1003 0.395,1004 0.273,1005 0.724,1006 0.826,1008 0.774,1009 0.114,1010 0.051,1011 0.585,1012 0.568,1014 0.594,1017 0.313,1018 0.187,1020 0.251,1021 3.434,1022 4.779,1023 6.337,1024 7.995,1025 9.706,1027 5.746,1029 5.537,1030 9.47,1031 0.433,1033 -0.673,1034 0.565,1036 15.407,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 26.885,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.923,1049 3,1050 2.322,1051 21.146,1052 29,1053 24,1054 0.412,1055 100.519,1056 172.87,1057 237.027,1058 1665,1059 4.3,1060 10.293,1061 0.735,1062 0.574,1063 10.793,1064 8.03,1065 6.592,1066 0.439,1067 0.303,1068 4.132,1069 6.026,1070 4.034,1071 3.302,1072 6.881,1073 4.54,1074 6.273,1075 0.285,1076 0.167,1077 6.682,1078 3.67,1079 5.387,1080 0.186,1081 0.085,1082 5.649,1083 2.476,1084 4.024,1085 0.112,1086 0.046,1087 4.244,1088 1.673,1089 3.332,1090 0.072,1091 0.027,1092 3.643,1093 1.229,1094 0.586,1095 44.794,1096 0.327,1097 13.59,1098 1.315,1099 74,1100 251.046,1101 97.279,1102 271.672,1103 349.17,1104 248,1105 88,1106 230.765,1107 106.766,1108 239.845,1109 349.71,1110 225,1111 6.928}
{0 CHEMBL2047862,1 1.614,2 5.357,3 0.435,4 0.189,5 52.435,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.576,13 2.862,14 3.87,15 4.036,16 3.297,17 3.275,18 4.988,19 3.246,20 4.164,21 4.34,22 3.431,23 3.407,24 5.548,25 3.365,26 4.236,27 4.465,28 3.151,29 3.253,30 5.465,31 3.176,32 3.96,33 4.206,34 2.736,35 2.923,36 5.146,37 2.83,38 3.619,39 3.883,40 2.079,41 2.507,42 4.746,43 2.339,44 3.228,45 3.578,46 1.169,47 1.892,48 4.1,49 1.622,50 2.177,51 2.523,52 0.395,53 1.068,54 2.996,55 0.848,56 0.105,57 0.382,58 5.588,59 2.265,60 12.395,61 3.008,62 0.123,63 0.599,64 9.672,65 3.839,66 16.746,67 5.304,68 0.301,69 0.729,70 13.746,71 4.838,72 56.638,73 6.686,74 0.355,75 0.666,76 16.416,77 4.74,78 58.673,79 6.794,80 0.274,81 0.483,82 12.739,83 3.469,84 41.707,85 5.027,86 0.192,87 0.316,88 9.212,89 2.646,90 33.809,91 3.847,92 0.159,93 0.177,94 6.917,95 1.733,96 30.387,97 2.777,98 0.047,99 0.07,100 2.135,101 0.409,102 8.021,103 0.799,104 17,105 22,106 0.326,107 0.723,108 0.828,109 0.865,110 0.881,111 0.881,112 2.737,113 0.895,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,119 1,123 1,128 3,129 2,130 1,135 1,137 6,139 1,140 2,142 1,143 7,144 1,146 4,148 2,149 3,150 3,151 5,153 1,155 4,158 1,159 4,160 1,161 2,163 1,165 2,168 4,169 1,171 2,173 2,177 1,179 1,185 1,186 1,194 140,195 9,196 9,197 9,198 9,199 9,200 8.142,201 11.701,202 5.062,203 9.083,204 7.336,205 7.336,206 7.336,207 7.336,208 7.336,209 5.935,210 11.782,211 2.381,212 7.439,213 3.086,214 1.116,215 0.597,216 0.414,217 0.337,218 0.337,219 3.369,221 154,222 1.732,223 57.448,224 49.428,226 0.837,227 18.898,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 75,235 4.434,236 4.327,237 6.708,238 4.158,239 3.18,240 3.991,241 2.291,242 10.739,243 3.105,244 3.85,245 3.327,246 5.854,247 3.522,248 2.52,249 3.148,250 1.257,251 7.789,252 2.52,253 3.4,254 2.913,255 5.183,256 3.048,257 2.046,258 2.678,259 0.08,260 6.048,261 2.049,262 3.146,263 2.397,264 4.943,265 2.989,266 2.024,267 2.249,269 5.684,270 1.948,271 2.47,272 1.911,273 3.907,274 2.085,275 1.088,276 1.44,278 2.809,279 1.081,280 1.827,281 1.435,282 3.157,283 1.427,284 0.369,285 0.476,286 0.845,287 0.386,288 1.333,289 0.627,290 2.812,291 1.112,292 0.126,293 0.144,294 0.298,295 0.124,296 0.616,297 0.067,298 2.353,299 0.325,300 -0.659,301 -0.743,302 -1.627,303 -0.646,304 0.496,305 -0.361,306 1.867,307 0.186,308 -0.802,309 -1.006,310 -2.291,311 -0.79,313 -0.528,314 1.729,315 -0.232,316 -1.24,317 -1.475,318 -3.136,319 -1.234,320 -0.064,321 -0.938,322 1.384,323 -0.319,324 -1.346,325 -1.631,326 -3.466,327 -1.383,328 -0.455,329 -1.112,330 1.212,331 -0.558,332 -1.522,333 -1.845,335 -4.696,336 -1.482,337 -0.5,338 -1.558,339 1.118,340 -0.803,341 -1.784,342 -2.182,343 -0.67,344 -5.384,345 -1.731,346 -0.607,347 -1.669,348 1.077,349 -1,350 -2,351 -2.246,352 -1.313,353 -6.112,354 -1.948,355 -0.946,356 -2,357 0.695,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.502,363 -2,364 6.467,365 0.462,366 0.494,367 0.035,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.608,375 0.686,376 15.733,377 0.605,378 10.582,379 0.756,380 3.377,381 0.241,382 3.215,383 0.23,384 0.242,386 0.448,389 0.743,390 1.071,391 0.831,392 0.922,393 0.82,394 0.893,395 0.565,396 1.164,397 0.715,398 1.034,399 0.589,400 0.921,401 0.743,402 1.208,403 0.959,404 1.232,405 0.75,406 1.152,407 1.268,408 1.041,409 1.119,410 1.047,411 1.231,412 1.055,413 1.414,414 0.917,415 1.197,416 0.965,417 1.242,418 1.021,419 1.297,420 0.997,421 1.271,422 1.122,423 1.33,424 1.195,425 1.056,426 0.562,427 0.868,428 0.567,429 1.302,430 0.682,431 0.771,432 0.548,433 1.248,434 0.681,435 0.786,436 0.939,437 3.5,439 2.222,440 1.25,441 1.249,442 0.313,443 0.161,447 1105,448 3313,449 1.952,450 46.2,451 3,452 4,454 3,455 2,456 1.516,457 1.75,458 2.493,459 1.383,462 41.973,463 1.614,464 3.584,465 4.104,466 4.287,467 4.364,468 4.364,469 1.924,470 3.039,471 3.785,472 2.486,473 226.237,474 6.338,475 1730.17,476 122.211,477 1.557,478 3.689,479 0.233,481 0.101,482 0.054,483 0.078,484 0.031,485 0.04,489 0.538,490 0.67,491 0.788,492 51.071,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.138,498 0.097,499 0.086,500 -0.012,501 0.135,502 0.048,503 0.007,504 0.093,505 0.182,506 -0.128,507 -0.052,508 -0.222,509 0.176,510 -0.192,511 -0.129,512 -0.123,513 -0.125,514 -0.122,515 -0.082,516 -0.124,517 -0.247,518 -0.028,519 -0.183,520 -0.067,521 -0.132,522 -0.099,523 -0.199,524 -0.194,525 -0.256,526 -0.211,527 -0.175,528 -0.245,529 -0.062,530 0.059,531 0.227,532 0.285,533 -0.097,534 0.302,535 -0.163,536 0.329,537 -0.22,538 0.051,539 -0.199,540 -0.041,541 2.108,542 4.35,543 0.714,544 6,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.135,552 3.401,553 3.611,554 3.85,555 3.784,556 3.664,557 3.497,558 3.332,559 2.398,560 3.33,561 0.619,562 192.24,563 2.773,564 4.317,565 5.176,566 6.066,567 6.946,568 7.838,569 8.724,570 9.615,571 10.503,572 11.395,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 15,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,633 1,635 1,636 1,639 7.7,640 1,642 1,645 8,646 4.733,647 3.028,648 1.425,649 1.371,650 1.238,651 0.922,652 2.114,653 7.123,654 2.996,655 3.57,656 4.082,657 4.542,658 5.065,659 5.134,660 5.214,661 5.339,662 5.243,663 4.467,664 0.75,665 23,666 5.178,667 0.002,668 2.264,669 8.107,670 9.603,671 0.001,672 7.959,673 -0.001,674 2.607,675 36.5,676 0.003,677 105.94,678 53.621,679 32.897,681 67.951,683 53.621,684 173.891,685 32.897,686 8.825,687 35.432,688 71.234,689 29.85,690 9.128,692 105.94,694 105.94,695 86.518,696 67.951,698 82.398,699 48.687,700 42.806,701 44.257,702 42.261,704 105.94,705 100.848,706 53.621,707 105.94,708 16.367,709 37.254,710 100.848,711 105.94,712 100.848,713 53.621,714 0.603,715 0.362,716 0.181,717 0.104,718 12,719 6,722 1,723 1.2,724 2.485,725 91.367,726 0.2,727 10,728 53.303,729 9.339,730 3.17,731 1.472,732 100.848,733 5.606,734 2.466,735 75.703,736 260.409,737 19,738 11.35,740 -0.442,741 26.276,742 29.491,743 0.343,744 0.763,745 0.873,746 0.912,747 0.928,748 0.928,749 4.256,750 -0.659,751 5.209,752 0.298,753 3.807,754 4.248,755 2.543,756 6.061,757 3.779,758 5.473,759 -0.802,760 6.812,761 -1.627,762 3.611,763 4.182,764 2.078,765 7.04,766 3.559,767 6.793,768 -1.24,769 8.512,770 -2.291,771 5.451,772 6.377,773 3.726,774 10.15,775 5.386,776 8.143,777 -1.346,778 10.264,779 -3.136,780 5.994,781 7.034,782 3.934,783 11.89,784 5.902,785 9.52,786 -1.522,787 12.047,788 -3.466,789 7.388,790 8.789,791 5.161,792 14.562,793 7.28,794 10.918,795 -1.784,796 13.853,797 -4.696,798 8.263,799 9.78,800 5.695,801 16.64,802 8.125,803 12.331,804 -2,805 15.676,806 -5.384,807 9.498,808 11.354,809 6.718,810 19.145,811 9.339,812 3.18,813 -2,814 17.512,815 -6.112,816 10.526,817 12.519,818 7.405,819 21.381,820 10.337,821 2.52,822 10.739,823 19.359,824 -7.502,825 11.703,826 14.006,827 8.33,828 23.814,829 11.491,830 2.046,831 7.789,832 21.214,833 3.991,834 12.8,835 15.266,836 9.089,837 26.123,838 12.559,839 2.024,840 6.048,841 23.077,842 3.148,843 13.958,844 16.707,845 9.966,846 28.524,847 13.693,848 1.088,849 5.684,850 24.946,851 2.678,852 15.087,853 18.02,854 10.76,855 30.867,856 14.794,857 0.369,858 2.809,859 26.821,860 2.249,861 16.24,862 19.436,863 11.613,864 33.253,865 15.922,866 0.126,867 0.845,868 28.699,869 1.44,870 17.383,871 20.779,872 12.425,873 35.612,874 17.038,875 1192,876 2123,877 9.364,878 16.727,879 23.186,880 25.625,881 24.306,882 22.776,883 22.703,884 28.254,885 7.256,886 68.427,887 22.425,888 5.379,889 6.327,890 6.013,891 5.196,892 5.18,893 6.991,894 3.935,895 18.241,896 5.105,897 7.9,898 1.546,899 1.708,900 1.62,901 1.518,902 1.514,903 1.884,904 0.484,905 4.562,906 1.495,907 4.006,908 4.036,909 3.954,910 3.924,911 7.429,912 3.925,913 3.599,914 3.647,915 3.513,916 3.436,917 6.465,918 3.446,919 3.15,920 3.21,921 3.035,922 2.966,923 4.987,924 2.966,925 3.097,926 3.184,927 2.927,928 2.815,929 4.683,930 2.834,931 2.738,932 2.827,933 2.595,934 2.535,935 3.907,936 2.543,937 2.661,938 2.763,939 2.357,940 2.31,941 3.647,942 2.314,943 2.476,944 2.524,945 2.283,946 1.99,947 3.372,948 2.012,949 2.168,950 2.264,951 1.887,952 1.739,953 2.814,954 1.808,955 0.296,956 0.288,957 0.447,958 0.277,959 0.212,960 4.434,961 0.266,962 4.327,963 0.153,964 6.708,965 0.716,966 4.158,967 0.207,968 3.18,969 3.991,970 2.291,971 10.739,972 3.105,973 1.97,974 1.944,975 2.076,976 2.079,977 1.282,978 2.077,979 1.557,980 1.509,981 1.763,982 1.755,983 0.936,984 1.759,985 1.131,986 1.063,987 1.451,988 1.369,989 0.522,990 1.403,991 0.986,992 0.919,993 1.195,994 1.351,995 0.252,996 1.295,997 0.723,998 0.655,999 1.114,1000 1.04,1001 0.115,1002 1.081,1003 0.601,1004 0.485,1005 0.914,1006 0.922,1008 0.937,1009 0.3,1010 0.195,1011 0.693,1012 0.799,1014 0.743,1015 0.087,1016 0.01,1017 0.573,1018 0.48,1020 0.524,1021 3.434,1022 4.779,1023 6.337,1024 7.995,1025 9.706,1026 1.91,1029 5.57,1030 9.529,1031 0.492,1033 -0.629,1034 0.649,1036 16.106,1037 41.973,1038 93.192,1039 106.702,1040 111.457,1041 113.457,1042 113.457,1043 25.463,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.923,1049 3,1050 2.322,1051 21.146,1052 29,1053 24,1054 0.412,1055 101.779,1056 174.96,1057 240.1,1058 1665,1060 10.293,1061 0.735,1062 0.564,1063 10.293,1064 7.897,1065 6.592,1066 0.439,1067 0.298,1068 4.413,1069 6.334,1070 4.278,1071 3.56,1072 6.592,1073 4.473,1074 6.273,1075 0.285,1076 0.163,1077 6.273,1078 3.593,1079 5.387,1080 0.186,1081 0.084,1082 5.387,1083 2.435,1084 4.024,1085 0.112,1086 0.046,1087 4.024,1088 1.644,1089 3.332,1090 0.072,1091 0.026,1092 3.332,1093 1.195,1094 0.586,1095 41.619,1096 0.327,1097 13.59,1098 1.315,1099 74,1100 224.843,1101 81.76,1102 218.436,1103 290.37,1104 200,1105 88,1106 213.902,1107 97.007,1108 215.053,1109 312.57,1110 201,1111 6.434}
{0 CHEMBL2049092,1 1.681,2 6.067,3 -0.067,4 0.005,5 53.857,6 7.713,7 0.375,8 3.431,9 3.541,10 3.001,11 2.868,12 4.67,13 2.886,14 3.923,15 4.073,16 3.36,17 3.248,18 5.084,19 3.254,20 4.171,21 4.331,22 3.508,23 3.385,24 5.585,25 3.382,26 4.229,27 4.423,28 3.267,29 3.283,30 5.52,31 3.238,32 4.075,33 4.312,34 2.932,35 3.002,36 5.287,37 2.923,38 3.73,39 3.99,40 2.478,41 2.549,42 4.92,43 2.47,44 3.255,45 3.486,46 1.857,47 2.142,48 4.431,49 2.007,50 3.004,51 3.316,52 1.14,53 1.671,54 3.951,55 1.476,56 0.139,57 0.387,58 5.585,59 2.292,60 13.437,61 2.898,62 0.251,63 0.589,64 10.164,65 3.714,66 22.915,67 4.886,68 0.411,69 0.706,70 13.476,71 4.585,72 61.343,73 6.106,74 0.482,75 0.658,76 15.58,77 4.6,78 58.026,79 6.317,80 0.447,81 0.51,82 14.4,83 3.928,84 53.731,85 5.762,86 0.392,87 0.33,88 10.783,89 2.461,90 38.907,91 3.763,92 0.224,93 0.197,94 6.416,95 1.782,96 28.033,97 2.492,98 0.191,99 0.13,100 5.715,101 1.197,102 26.594,103 1.922,104 18,105 23,106 0.336,107 0.751,108 0.851,109 0.886,110 0.886,111 0.886,112 2.797,113 0.86,114 -1.73,115 -1.8,116 -1.82,117 37,119 1,121 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 4,142 1,143 4,144 1,146 4,148 2,149 3,150 3,151 3,153 1,154 1,155 4,158 1,159 3,160 1,163 1,165 2,167 1,168 3,171 2,172 1,173 1,183 1,184 1,194 185,195 9.87,196 9.87,197 9.87,198 9.87,199 9.87,200 9.065,201 13.589,202 5.565,203 10.132,204 7.763,205 7.763,206 7.763,207 7.763,208 7.763,209 6.358,210 14.751,211 2.528,212 8.055,213 3.074,214 1.001,215 0.5,216 0.324,217 0.324,218 0.324,219 3.436,221 186,222 2,223 63.988,224 55.012,226 0.889,227 22.096,228 1,229 1,230 1,231 0.5,232 0.93,233 34,234 91,235 4.437,236 4.327,237 6.71,238 4.158,239 3.182,240 3.998,241 2.291,242 10.749,243 3.102,244 3.872,245 3.328,246 5.864,247 3.535,248 2.555,249 3.17,250 1.257,251 7.862,252 2.502,253 3.459,254 2.973,255 5.216,256 3.091,257 2.134,258 2.73,259 0.86,260 6.426,261 2.031,262 3.147,263 2.62,264 5.181,265 2.992,266 2.027,267 2.249,268 0.08,269 5.986,270 1.947,271 2.475,272 1.946,273 3.909,274 2.087,275 1.092,276 1.445,278 2.81,279 1.083,280 1.827,281 1.437,282 3.178,283 1.458,284 0.569,285 0.625,286 0.985,287 0.495,288 1.703,289 1.129,290 2.936,291 1.412,292 0.366,293 0.474,294 0.816,295 0.381,296 1.063,297 0.504,298 2.64,299 0.843,300 -0.1,301 -0.111,302 -0.199,303 -0.093,304 0.606,305 -0.008,306 2.175,307 0.188,308 -0.797,309 -0.938,310 -1.992,311 -0.774,312 0.374,313 -0.516,314 1.738,315 0.087,316 -0.866,317 -1.085,318 -2.404,319 -0.819,321 -0.53,322 1.631,323 -0.249,324 -1.286,325 -1.564,326 -3.256,327 -1.287,328 -0.392,329 -0.948,330 1.316,331 -0.555,332 -1.518,333 -1.651,335 -4.026,336 -1.403,337 -0.482,338 -1.144,339 1.211,340 -0.613,341 -1.525,342 -1.874,343 -0.67,344 -4.705,345 -1.484,346 -0.5,347 -1.569,348 1.1,349 -0.896,350 -1.832,351 -2.183,352 -0.86,353 -5.424,354 -1.733,355 -0.644,356 -1.669,357 0.744,358 -1,359 -2,360 -2.287,361 -1.313,362 -6.128,363 -1.948,364 6.8,365 0.453,366 0.456,367 0.03,368 18.25,369 1.217,370 8.5,371 0.567,372 9.75,373 0.65,374 9.891,375 0.659,376 17.2,377 0.637,378 12.21,379 0.814,380 3.821,381 0.255,382 3.309,383 0.221,384 0.23,386 0.426,389 0.814,390 1.186,391 0.789,392 1.035,393 0.829,394 0.918,395 0.886,396 1.127,397 0.77,398 0.969,399 0.675,400 0.857,401 0.864,402 1.166,403 0.916,404 1.154,405 0.8,406 1.062,407 1.164,408 1.102,409 1.188,410 1.158,411 1.313,412 1.18,413 0.998,414 1.046,415 1.032,416 1.071,417 1.098,418 1.066,419 1.136,420 0.732,421 1.067,422 0.785,423 0.95,424 0.875,425 1.24,426 0.915,427 1.328,428 1.123,429 1.339,430 1.262,431 1.339,432 0.566,433 1.093,434 0.528,435 1.429,436 0.732,437 3.5,439 2.222,440 1.25,441 1.289,442 0.431,443 0.222,444 0.059,447 1358,448 4586,449 1.955,450 44.4,452 7,454 3,455 2,456 1.537,457 1.765,458 2.632,459 1.378,462 45.388,463 1.681,464 3.754,465 4.255,466 4.431,467 4.431,468 4.431,469 2.149,470 3.323,471 3.88,472 2.651,473 278.373,474 6.528,475 2219.48,476 128.382,477 1.566,478 3.796,479 0.219,481 0.097,482 0.05,483 0.072,484 0.036,485 0.032,486 0.02,489 0.524,490 0.67,491 1.029,492 56.933,493 -0.033,494 0.084,495 0.007,496 0.086,497 -0.14,498 0.063,499 -0.057,500 0.015,501 0.09,502 0.106,503 -0.034,504 0.132,505 0.062,506 -0.066,507 -0.023,508 -0.133,509 0.16,510 -0.106,511 -0.129,512 -0.123,513 -0.235,514 -0.201,515 -0.141,516 -0.243,517 -0.001,518 -0.189,519 -0.025,520 -0.145,521 -0.058,522 -0.098,523 -0.021,524 0.077,525 0.001,526 0.062,527 0.016,528 0.054,529 -0.098,530 -0.13,531 -0.294,532 -0.202,533 -0.138,534 -0.304,535 -0.214,536 0.048,537 0.054,538 0.286,539 -0.178,540 0.238,541 2.157,542 4.398,543 0.667,544 7.333,545 1.022,546 1.137,547 0.505,548 0.255,549 0.636,550 2.833,551 3.178,552 3.466,553 3.664,554 3.912,555 3.912,556 3.829,557 3.714,558 3.555,559 2.833,560 3.631,561 0.623,562 208.24,563 2.833,564 4.369,565 5.231,566 6.116,567 6.999,568 7.889,569 8.777,570 9.668,571 10.558,572 11.451,573 7.4,574 1,578 1,579 3,580 3,582 1,584 1,586 27,587 7,588 16,589 28,590 10,591 3,592 3,594 2,595 3,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 5,614 3,615 5,617 2,619 3,620 2,621 1,625 1,626 1,627 1,628 1,631 15,632 1,633 1,634 1,635 1,636 1,639 11.1,640 1,642 1,644 1,645 8.5,646 4.9,647 3.361,648 1.383,649 1.366,650 1.232,651 0.907,652 2.542,653 7.255,654 3.045,655 3.597,656 4.131,657 4.589,658 5.121,659 5.253,660 5.383,661 5.466,662 5.424,663 4.707,664 1,665 25,666 5.533,667 -0.001,668 2.395,669 8.167,670 10.137,672 8.203,674 2.667,675 40,676 0.002,677 105.94,678 57.737,679 32.897,681 78.95,683 57.737,684 184.89,685 32.897,686 10.883,687 35.432,688 71.234,689 29.85,690 22.186,692 105.94,694 105.94,695 90.634,696 78.95,698 82.398,699 59.687,700 42.806,701 35.432,702 55.202,704 105.94,705 111.848,706 57.737,707 105.94,708 18.425,709 39.312,710 111.848,711 105.94,712 111.848,713 57.737,714 0.592,715 0.368,716 0.182,717 0.103,718 12,719 6,720 0.036,721 1,722 1,723 1.2,724 2.594,725 99.968,726 0.2,727 10,728 58.603,729 10.265,730 3.715,731 1.662,732 111.848,733 5.179,734 1.877,735 75.703,736 275.524,737 20,738 11.398,740 -0.49,741 27.604,742 30.701,743 0.354,744 0.79,745 0.895,746 0.932,747 0.932,748 0.932,749 4.297,750 -0.1,751 5.252,752 0.816,753 3.85,754 4.277,755 2.653,756 6.103,757 3.79,758 5.502,759 -0.797,760 6.853,761 -0.199,762 3.611,763 4.182,764 2.078,765 7.086,766 3.525,767 6.818,768 -0.866,769 8.552,770 -1.992,771 5.493,772 6.401,773 3.752,774 10.188,775 5.381,776 8.167,777 -1.286,778 10.302,779 -2.404,780 6.019,781 7.053,782 3.934,783 11.928,784 5.88,785 9.546,786 -1.518,787 12.085,788 -3.256,789 7.426,790 8.812,791 5.166,792 14.59,793 7.267,794 10.944,795 -1.525,796 13.889,797 -4.026,798 8.292,799 9.804,800 5.695,801 16.666,802 8.105,803 12.357,804 -1.832,805 15.71,806 -4.705,807 9.529,808 11.378,809 6.719,810 19.165,811 9.323,812 3.182,813 -2,814 17.543,815 -5.424,816 10.552,817 12.544,818 7.405,819 21.399,820 10.318,821 2.555,822 10.749,823 19.387,824 -6.128,825 11.729,826 14.03,827 8.33,828 23.83,829 11.474,830 2.134,831 7.862,832 21.24,833 3.998,834 12.823,835 15.292,836 9.089,837 26.138,838 12.54,839 2.027,840 6.426,841 23.1,842 3.17,843 13.981,844 16.732,845 9.966,846 28.538,847 13.675,848 1.092,849 5.986,850 24.967,851 2.73,852 15.107,853 18.048,854 10.76,855 30.881,856 14.775,857 0.569,858 2.81,859 26.839,860 2.249,861 16.26,862 19.463,863 11.613,864 33.268,865 15.903,866 0.366,867 0.985,868 28.716,869 1.445,870 17.402,871 20.809,872 12.425,873 35.627,874 17.018,875 1459,876 2739,877 10.057,878 17.182,879 24.342,880 26.875,881 25.737,882 23.905,883 23.848,884 29.385,885 8.976,886 71.269,887 23.081,888 5.383,889 6.327,890 6.257,891 5.198,892 5.182,893 6.998,894 3.935,895 18.251,896 5.102,897 8.47,898 1.521,899 1.68,900 1.609,901 1.494,902 1.491,903 1.837,904 0.561,905 4.454,906 1.443,907 3.999,908 4.025,909 3.952,910 3.903,911 7.429,912 3.91,913 3.585,914 3.622,915 3.511,916 3.397,917 6.465,918 3.416,919 3.219,920 3.289,921 3.062,922 2.95,923 4.99,924 2.964,925 3.126,926 3.187,927 2.995,928 2.842,929 4.83,930 2.861,931 2.819,932 2.924,933 2.641,934 2.618,935 4.338,936 2.615,937 2.721,938 2.776,939 2.555,940 2.45,941 3.651,942 2.477,943 2.507,944 2.574,945 2.297,946 2.053,947 3.593,948 2.068,949 2.27,950 2.34,951 2.015,952 1.755,953 3.037,954 1.845,955 0.277,956 0.27,957 0.419,958 0.26,959 0.199,960 4.437,961 0.25,962 4.327,963 0.143,964 6.71,965 0.672,966 4.158,967 0.194,968 3.182,969 3.998,970 2.291,971 10.749,972 3.102,973 1.949,974 1.926,975 2.046,976 2.072,977 1.264,978 2.062,979 1.514,980 1.475,981 1.701,982 1.739,983 0.837,984 1.726,985 1.17,986 1.095,987 1.543,988 1.477,989 0.565,990 1.5,991 1.004,992 0.948,993 1.212,994 1.353,995 0.266,996 1.295,997 0.79,998 0.714,999 1.13,1000 1.109,1001 0.128,1002 1.136,1003 0.655,1004 0.588,1005 0.931,1006 0.931,1008 0.952,1009 0.373,1010 0.253,1011 0.729,1012 0.823,1014 0.768,1015 0.108,1016 0.042,1017 0.587,1018 0.569,1020 0.586,1021 3.497,1022 4.828,1023 6.382,1024 8.037,1025 9.745,1026 1.528,1029 5.572,1030 9.568,1031 0.44,1032 5.01,1033 -0.67,1034 0.589,1036 16.821,1037 45.388,1038 101.362,1039 114.872,1040 119.627,1041 119.627,1042 119.627,1043 28.362,1044 5.889,1045 75.79,1046 75.79,1047 12,1048 11.978,1049 3,1050 2.322,1051 23.436,1052 33,1053 34,1054 0.389,1055 105.775,1056 183.75,1057 249.85,1058 1991,1060 11,1061 0.733,1062 0.554,1063 11,1064 8.305,1065 7.13,1066 0.446,1067 0.287,1068 4.484,1069 6.715,1070 4.376,1071 3.629,1072 7.13,1073 4.586,1074 6.442,1075 0.28,1076 0.15,1077 6.442,1078 3.455,1079 5.811,1080 0.187,1081 0.08,1082 5.811,1083 2.486,1084 4.267,1085 0.112,1086 0.043,1087 4.267,1088 1.64,1089 3.461,1090 0.071,1091 0.023,1092 3.461,1093 1.134,1094 0.562,1095 45.962,1096 0.315,1097 14.66,1098 1.209,1099 78,1100 272.578,1101 88.638,1102 255.881,1103 338.17,1104 236,1105 93,1106 244.448,1107 104.665,1108 243.873,1109 353.94,1110 227,1111 6.863}
{0 CHEMBL2049093,1 1.869,2 5.429,3 0.613,4 0.376,5 52.199,6 9.246,7 0.4,8 3.285,9 3.388,10 3.003,11 2.821,12 4.551,13 2.821,14 3.761,15 3.889,16 3.423,17 3.233,18 4.991,19 3.214,20 4.09,21 4.25,22 3.545,23 3.351,24 5.549,25 3.318,26 4.076,27 4.27,28 3.285,29 3.157,30 5.433,31 3.106,32 3.802,33 4.004,34 2.918,35 2.824,36 5.104,37 2.724,38 3.368,39 3.635,40 2.712,41 2.3,42 4.737,43 2.157,44 2.476,45 2.702,46 1.786,47 1.484,48 3.972,49 1.274,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.142,57 0.334,58 3.482,59 1.88,60 16.362,61 2.121,62 0.189,63 0.519,64 6.349,65 3.316,66 22.002,67 3.951,68 0.438,69 0.627,70 13.164,71 4.613,72 68.768,73 5.477,74 0.494,75 0.545,76 14.216,77 4.347,78 67.608,79 4.94,80 0.415,81 0.367,82 13.469,83 3.543,84 55.617,85 4.043,86 0.313,87 0.198,88 11.632,89 2.469,90 44.61,91 3.239,92 0.173,93 0.056,94 7.714,95 1.131,96 22.264,97 1.332,98 0.016,99 0.012,100 0.94,101 0.189,102 2.29,103 0.33,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.908,114 -2.52,115 -2.55,116 -2.49,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 5,153 1,155 2,158 1,159 4,160 1,161 2,163 1,165 3,168 1,171 1,177 3,179 2,181 1,194 128,195 9,196 9,197 9,198 9,199 9,200 8.142,201 10.877,202 5.06,203 9.219,204 7.336,205 7.336,206 7.336,207 7.336,208 7.336,209 5.935,210 10.006,211 2.377,212 7.708,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,220 1,221 156,222 1.732,223 57.448,224 49.428,226 0.857,227 21.907,228 0.83,229 1,230 0.8,232 0.8,233 31.333,234 76,235 4.431,236 4.326,237 6.704,238 4.153,239 3.178,240 3.988,241 2.291,242 10.72,243 3.093,244 3.863,245 3.327,246 5.856,247 3.5,248 2.53,249 3.172,250 1.257,251 7.815,252 2.452,253 3.397,254 3.046,255 5.248,256 3.051,257 2.119,258 2.652,259 0.08,260 6.262,261 1.972,262 3.119,263 2.604,264 4.862,265 2.855,266 1.916,267 2.232,269 5.412,270 1.697,271 2.488,272 1.974,273 3.921,274 2.118,275 1.133,276 1.475,278 2.893,279 1.106,280 1.885,281 1.469,282 3.174,283 1.472,284 0.429,285 0.552,286 0.977,287 0.431,288 1.155,289 0.648,290 2.799,291 0.887,292 -0.074,293 -0.085,294 -0.184,295 -0.066,296 0.871,297 0.209,298 2.354,299 0.464,300 -0.396,301 -0.465,302 -0.964,303 -0.285,304 0.34,305 -0.086,306 1.867,307 -0.016,308 -1,309 -1.213,310 -2.75,311 -0.938,313 -0.647,314 1.728,315 -0.243,316 -1.19,317 -1.391,318 -3.048,319 -0.984,320 -0.041,321 -0.897,322 1.384,323 -0.469,324 -1.333,325 -1.657,326 -3.454,327 -1.357,328 -0.455,329 -1.049,330 1.215,331 -0.578,332 -1.527,333 -1.834,335 -4.735,336 -1.478,337 -0.5,338 -1.536,339 1.172,340 -0.855,341 -1.784,342 -2.17,343 -0.67,344 -5.372,345 -1.695,346 -0.607,347 -1.668,348 1,349 -1,350 -2,351 -2.257,352 -1.313,353 -6.065,354 -1.947,355 -0.946,356 -2,357 0.715,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.507,363 -2,364 6.681,365 0.477,366 0.494,367 0.035,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 9.531,375 0.681,376 15.519,377 0.675,378 10.638,379 0.76,380 3.409,381 0.243,382 3.183,383 0.227,384 0.267,386 0.434,389 0.728,390 1.014,391 0.57,392 0.69,393 0.809,394 0.725,395 0.608,396 1.242,397 0.586,398 0.926,399 0.613,400 0.892,401 0.827,402 1.111,403 0.917,404 1.079,405 0.781,406 1.055,407 1.344,408 0.979,409 0.952,410 0.921,411 1.331,412 1.025,413 1.442,414 0.999,415 1.279,416 1.124,417 1.462,418 1.199,419 0.819,420 0.73,421 1.101,422 0.945,423 0.939,424 0.846,425 1.191,426 0.43,427 3.183,428 1.871,429 0.895,430 1.455,437 3.5,439 2.222,440 1.375,441 1.169,442 0.368,443 0.161,447 1109,448 4627,449 1.952,450 39.1,452 4,454 3,455 2,456 1.515,457 1.75,458 2.495,459 1.453,461 1,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.924,470 2.807,471 3.784,472 2.498,473 227.318,474 6.335,475 1735.81,476 104.042,477 1.557,478 3.689,479 0.233,481 0.101,482 0.06,483 0.073,484 0.041,485 0.032,489 0.54,490 0.67,491 0.788,492 51.119,493 -0.04,494 0.22,495 -0.025,496 0.208,497 -0.15,498 0.119,499 0.031,500 -0.091,501 0.046,502 -0.001,503 -0.007,504 0.011,505 0.068,506 -0.084,507 -0.084,508 -0.153,509 0.129,510 -0.141,511 -0.25,512 -0.054,513 -0.115,514 -0.019,515 -0.16,516 -0.104,517 -0.279,518 -0.173,519 -0.201,520 -0.156,521 -0.302,522 -0.225,523 0.25,524 -0.03,525 0.355,526 0.11,527 0.131,528 0.279,529 0.164,530 0.134,531 -0.538,532 -0.563,533 0.194,534 -0.262,535 0.534,536 0.494,537 1.038,538 1.012,539 0.443,540 1.426,541 2.153,542 4.291,543 0.714,544 6.163,545 1.031,546 1.131,547 1.292,548 1.671,549 0.688,550 2.773,551 3.135,552 3.401,553 3.611,554 3.829,555 3.829,556 3.638,557 3.526,558 3.258,559 2.485,560 3.348,561 0.67,562 212.65,563 2.773,564 4.317,565 5.176,566 6.066,567 6.944,568 7.838,569 8.72,570 9.615,571 10.499,572 11.394,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,596 1,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,612 9,613 4,614 3,615 5,616 1,617 2,619 2,620 2,621 1,625 1,626 1,627 1,629 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.028,648 1.21,649 1.371,650 1.238,651 0.927,652 2.286,653 7.123,654 2.996,655 3.57,656 4.082,657 4.542,658 5.051,659 5.16,660 5.236,661 5.292,662 5.234,663 4.523,664 0.75,665 23,666 5.158,667 0.002,668 2.284,669 8.258,670 9.389,671 0.001,672 7.793,673 -0.001,674 2.758,675 38.611,676 0.002,677 70.627,678 45.111,679 32.897,680 39.149,681 67.951,683 45.111,684 177.726,685 32.897,687 35.432,688 71.234,689 29.85,690 9.443,692 70.627,693 39.149,694 70.627,695 78.008,696 67.951,697 39.149,698 47.084,699 48.687,700 42.806,701 35.432,702 42.576,703 39.149,704 70.627,705 100.848,706 84.259,707 70.627,708 16.682,709 28.429,710 139.996,711 70.627,712 100.848,713 84.259,714 0.603,715 0.362,716 0.181,717 0.099,718 12,719 6,722 1,723 1.2,724 2.487,725 91.288,726 0.2,727 10,728 53.303,729 9.614,730 3.329,731 1.565,732 100.848,733 4.918,734 1.812,735 75.703,736 255.734,737 19,738 11.291,740 -0.486,741 23.716,742 26.02,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.396,751 5.209,752 -0.184,753 3.807,754 4.248,755 2.543,756 6.061,757 3.723,758 5.473,759 -1,760 6.812,761 -0.964,762 3.611,763 4.182,764 2.078,765 7.04,766 3.451,767 6.793,768 -1.19,769 8.512,770 -2.75,771 5.451,772 6.377,773 3.726,774 10.149,775 5.309,776 8.143,777 -1.333,778 10.264,779 -3.048,780 5.994,781 7.034,782 3.934,783 11.887,784 5.802,785 9.52,786 -1.527,787 12.047,788 -3.454,789 7.388,790 8.789,791 5.161,792 14.557,793 7.199,794 10.918,795 -1.784,796 13.853,797 -4.735,798 8.263,799 9.78,800 5.695,801 16.633,802 8.039,803 12.33,804 -2,805 15.676,806 -5.372,807 9.497,808 11.354,809 6.718,810 19.135,811 9.264,812 3.178,813 -2,814 17.511,815 -6.065,816 10.524,817 12.518,818 7.405,819 21.368,820 10.261,821 2.53,822 10.72,823 19.357,824 -7.507,825 11.7,826 14.004,827 8.33,828 23.799,829 11.42,830 2.119,831 7.815,832 21.212,833 3.988,834 12.796,835 15.263,836 9.089,837 26.105,838 12.488,839 1.916,840 6.262,841 23.075,842 3.172,843 13.954,844 16.702,845 9.966,846 28.504,847 13.624,848 1.133,849 5.412,850 24.943,851 2.652,852 15.081,853 18.014,854 10.76,855 30.845,856 14.724,857 0.429,858 2.893,859 26.817,860 2.232,861 16.233,862 19.429,863 11.613,864 33.229,865 15.852,866 -0.074,867 0.977,868 28.695,869 1.475,870 17.374,871 20.771,872 12.425,873 35.586,874 16.966,875 1196,876 2485,877 9.364,878 15.824,879 23.167,880 25.717,881 24.332,882 22.856,883 22.61,884 28.142,885 7.256,886 68.159,887 21.502,888 5.376,889 6.326,890 5.99,891 5.192,892 5.178,893 6.988,894 3.935,895 18.227,896 5.093,897 7.923,898 1.544,899 1.714,900 1.622,901 1.524,902 1.507,903 1.876,904 0.484,905 4.544,906 1.433,907 3.995,908 4.022,909 4.04,910 3.914,911 7.429,912 3.915,913 3.565,914 3.604,915 3.658,916 3.405,917 6.465,918 3.415,919 3.133,920 3.187,921 3.188,922 2.883,923 4.996,924 2.902,925 2.894,926 2.983,927 2.997,928 2.724,929 4.904,930 2.723,931 2.742,932 2.775,933 2.666,934 2.483,935 4.273,936 2.512,937 2.515,938 2.597,939 2.374,940 2.07,941 3.733,942 2.078,943 2.299,944 2.364,945 2.196,946 1.782,947 3.3,948 1.867,949 1.698,950 1.869,951 1.964,952 1.441,953 2.99,954 1.36,955 0.295,956 0.288,957 0.447,958 0.277,959 0.212,960 4.431,961 0.266,962 4.326,963 0.153,964 6.704,965 0.715,966 4.153,967 0.206,968 3.178,969 3.988,970 2.291,971 10.72,972 3.093,973 1.95,974 1.927,975 2.036,976 2.062,977 1.263,978 2.056,979 1.505,980 1.465,981 1.673,982 1.694,983 0.83,984 1.695,985 1.012,986 0.967,987 1.226,988 1.347,989 0.268,990 1.288,991 0.828,992 0.764,993 1.085,994 1.148,995 0.077,996 1.169,997 0.66,998 0.608,999 0.95,1000 0.896,1002 0.931,1003 0.403,1004 0.272,1005 0.737,1006 0.835,1008 0.782,1009 0.114,1010 0.051,1011 0.59,1012 0.591,1014 0.61,1017 0.307,1018 0.188,1020 0.249,1021 3.434,1022 4.779,1023 6.337,1024 7.995,1025 9.705,1027 5.783,1029 5.539,1030 9.452,1031 0.409,1033 -0.689,1034 0.583,1036 15.407,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 26.798,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.922,1049 3,1050 2.322,1051 21.161,1052 30,1053 24,1054 0.41,1055 100.519,1056 172.87,1057 237.027,1058 1665,1059 4.3,1060 10.293,1061 0.735,1062 0.574,1063 10.793,1064 8.03,1065 6.592,1066 0.439,1067 0.303,1068 4.132,1069 6.026,1070 4.034,1071 3.302,1072 6.881,1073 4.54,1074 6.273,1075 0.285,1076 0.167,1077 6.682,1078 3.67,1079 5.38,1080 0.186,1081 0.085,1082 5.642,1083 2.471,1084 4.086,1085 0.113,1086 0.048,1087 4.32,1088 1.719,1089 3.153,1090 0.07,1091 0.026,1092 3.385,1093 1.176,1094 0.585,1095 44.794,1096 0.327,1097 13.603,1098 1.302,1099 74,1100 251.046,1101 97.279,1102 271.672,1103 349.17,1104 248,1105 88,1106 230.765,1107 106.766,1108 239.844,1109 349.68,1110 225,1111 6.588}
{0 CHEMBL2049094,1 1.614,2 5.429,3 0.435,4 0.189,5 52.435,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.576,13 2.862,14 3.87,15 4.036,16 3.297,17 3.275,18 4.988,19 3.246,20 4.164,21 4.34,22 3.431,23 3.407,24 5.549,25 3.365,26 4.235,27 4.466,28 3.144,29 3.262,30 5.468,31 3.183,32 3.952,33 4.186,34 2.672,35 2.944,36 5.112,37 2.822,38 3.671,39 3.993,40 2.159,41 2.494,42 4.638,43 2.322,44 3.149,45 3.442,46 1.329,47 1.923,48 4.248,49 1.723,50 2.675,51 3.064,52 0.346,53 1.136,54 3.497,55 0.845,56 0.105,57 0.382,58 5.588,59 2.265,60 12.395,61 3.008,62 0.123,63 0.599,64 9.672,65 3.839,66 16.746,67 5.304,68 0.301,69 0.729,70 13.746,71 4.838,72 56.653,73 6.686,74 0.363,75 0.665,76 16.44,77 4.771,78 58.356,79 6.8,80 0.248,81 0.484,82 12.398,83 3.736,84 43.928,85 5.295,86 0.183,87 0.337,88 10.105,89 2.597,90 28.817,91 4.234,92 0.144,93 0.183,94 5.919,95 1.399,96 24.406,97 2.18,98 0.117,99 0.076,100 4.251,101 0.908,102 21.568,103 1.497,104 17,105 22,106 0.326,107 0.723,108 0.844,109 0.881,110 0.881,111 0.881,112 2.737,113 0.895,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,119 1,123 1,128 3,129 2,130 1,135 1,137 6,139 1,140 2,142 1,143 7,144 1,146 4,148 2,149 3,150 3,151 6,153 1,155 3,158 1,159 4,160 1,161 2,163 1,165 3,168 3,171 2,173 1,177 3,179 2,181 1,194 128,195 9,196 9,197 9,198 9,199 9,200 8.142,201 11.701,202 5.06,203 9.083,204 7.336,205 7.336,206 7.336,207 7.336,208 7.336,209 5.935,210 11.336,211 2.377,212 7.441,213 3.086,214 1.116,215 0.52,216 0.337,217 0.337,218 0.337,219 3.369,221 156,222 1.732,223 57.448,224 49.428,226 0.857,227 18.802,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 76,235 4.431,236 4.326,237 6.704,238 4.156,239 3.178,240 3.988,241 2.291,242 10.72,243 3.104,244 3.863,245 3.326,246 5.856,247 3.532,248 2.53,249 3.172,250 1.257,251 7.815,252 2.529,253 3.397,254 2.931,255 5.248,256 3.097,257 2.119,258 2.652,259 0.08,260 6.262,261 2.071,262 3.119,263 2.337,264 4.862,265 2.909,266 1.916,267 2.232,269 5.412,270 1.895,271 2.488,272 1.955,273 3.921,274 2.124,275 1.133,276 1.475,278 2.893,279 1.121,280 1.885,281 1.469,282 3.174,283 1.485,284 0.429,285 0.552,286 0.977,287 0.447,288 1.155,289 0.55,290 2.799,291 0.912,292 -0.074,293 -0.085,294 -0.184,295 -0.072,296 0.871,297 -0.014,298 2.354,299 0.599,300 -0.396,301 -0.465,302 -0.964,303 -0.393,304 0.34,305 -0.096,306 1.867,307 -0.016,308 -1,309 -1.213,310 -2.75,311 -0.982,313 -0.718,314 1.728,315 -0.199,316 -1.19,317 -1.391,318 -3.048,319 -1.172,320 -0.041,321 -0.918,322 1.384,323 -0.292,324 -1.333,325 -1.657,326 -3.454,327 -1.388,328 -0.455,329 -1.078,330 1.215,331 -0.564,332 -1.527,333 -1.834,335 -4.735,336 -1.478,337 -0.5,338 -1.561,339 1.172,340 -0.803,341 -1.784,342 -2.17,343 -0.67,344 -5.372,345 -1.735,346 -0.607,347 -1.668,348 1,349 -1,350 -2,351 -2.257,352 -1.313,353 -6.065,354 -1.948,355 -0.946,356 -2,357 0.715,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.507,363 -2,364 6.467,365 0.462,366 0.494,367 0.035,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.616,375 0.687,376 15.733,377 0.605,378 10.552,379 0.754,380 3.377,381 0.241,382 3.215,383 0.23,384 0.242,386 0.448,389 0.743,390 1.071,391 0.831,392 0.922,393 0.82,394 0.893,395 0.565,396 1.164,397 0.715,398 1.034,399 0.589,400 0.921,401 0.743,402 1.208,403 0.959,404 1.232,405 0.748,406 1.152,407 1.279,408 0.966,409 1.128,410 1.006,411 1.222,412 1.033,413 1.329,414 1.139,415 1.267,416 1.185,417 1.288,418 1.224,419 0.836,420 0.797,421 0.853,422 0.789,423 0.791,424 0.809,425 1.444,426 0.775,427 1.414,428 0.947,429 1.402,430 1.129,431 1.313,433 0.642,434 0.007,435 1.672,436 0.18,437 3.5,439 2.222,440 1.375,441 1.169,442 0.368,443 0.161,447 1109,448 3337,449 1.952,450 46.2,451 3,452 4,454 3,455 2,456 1.515,457 1.75,458 2.495,459 1.383,462 41.973,463 1.614,464 3.584,465 4.181,466 4.364,467 4.364,468 4.364,469 1.924,470 2.807,471 3.784,472 2.498,473 227.318,474 6.335,475 1735.81,476 122.211,477 1.557,478 3.689,479 0.233,481 0.101,482 0.06,483 0.073,484 0.041,485 0.032,489 0.54,490 0.67,491 0.788,492 51.119,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.138,498 0.097,499 0.086,500 -0.012,501 0.135,502 0.048,503 0.007,504 0.093,505 0.182,506 -0.128,507 -0.052,508 -0.222,509 0.177,510 -0.192,511 -0.141,512 -0.045,513 -0.134,514 -0.079,515 -0.072,516 -0.1,517 -0.22,518 -0.266,519 -0.28,520 -0.243,521 -0.182,522 -0.277,523 -0.013,524 -0.009,525 0.179,526 0.074,527 0.042,528 0.159,529 -0.295,530 0.022,531 -0.359,532 -0.128,533 -0.267,534 -0.229,535 -0.081,536 0.461,537 0.561,538 0.776,539 -0.164,540 0.793,541 2.11,542 4.324,543 0.714,544 6.163,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.135,552 3.401,553 3.611,554 3.829,555 3.829,556 3.638,557 3.526,558 3.258,559 2.485,560 3.348,561 0.619,562 192.24,563 2.773,564 4.317,565 5.176,566 6.066,567 6.944,568 7.838,569 8.72,570 9.615,571 10.499,572 11.394,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 15,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,633 1,635 1,636 1,639 7.7,640 1,642 1,645 8,646 4.733,647 3.028,648 1.425,649 1.371,650 1.238,651 0.922,652 2.114,653 7.123,654 2.996,655 3.57,656 4.082,657 4.542,658 5.051,659 5.16,660 5.236,661 5.292,662 5.234,663 4.523,664 0.75,665 23,666 5.177,667 0.002,668 2.263,669 8.107,670 9.603,671 0.001,672 7.959,673 -0.001,674 2.607,675 36.5,676 0.003,677 105.94,678 53.621,679 32.897,681 67.951,683 53.621,684 173.891,685 32.897,686 8.825,687 35.432,688 71.234,689 29.85,690 9.128,692 105.94,694 105.94,695 86.518,696 67.951,698 82.398,699 48.687,700 42.806,701 44.257,702 42.261,704 105.94,705 100.848,706 53.621,707 105.94,708 16.367,709 37.254,710 100.848,711 105.94,712 100.848,713 53.621,714 0.603,715 0.362,716 0.181,717 0.099,718 12,719 6,722 1,723 1.2,724 2.487,725 91.288,726 0.2,727 10,728 53.303,729 9.339,730 3.17,731 1.472,732 100.848,733 5.519,734 2.556,735 75.703,736 260.409,737 19,738 11.324,740 -0.443,741 26.276,742 29.491,743 0.343,744 0.763,745 0.889,746 0.928,747 0.928,748 0.928,749 4.256,750 -0.396,751 5.209,752 -0.184,753 3.807,754 4.248,755 2.543,756 6.061,757 3.779,758 5.473,759 -1,760 6.812,761 -0.964,762 3.611,763 4.182,764 2.078,765 7.04,766 3.559,767 6.793,768 -1.19,769 8.512,770 -2.75,771 5.451,772 6.377,773 3.726,774 10.149,775 5.386,776 8.143,777 -1.333,778 10.264,779 -3.048,780 5.994,781 7.034,782 3.934,783 11.887,784 5.902,785 9.52,786 -1.527,787 12.047,788 -3.454,789 7.388,790 8.789,791 5.161,792 14.557,793 7.28,794 10.918,795 -1.784,796 13.853,797 -4.735,798 8.263,799 9.78,800 5.695,801 16.633,802 8.126,803 12.33,804 -2,805 15.676,806 -5.372,807 9.497,808 11.354,809 6.718,810 19.135,811 9.34,812 3.178,813 -2,814 17.511,815 -6.065,816 10.524,817 12.518,818 7.405,819 21.368,820 10.337,821 2.53,822 10.72,823 19.357,824 -7.507,825 11.7,826 14.004,827 8.33,828 23.799,829 11.491,830 2.119,831 7.815,832 21.212,833 3.988,834 12.796,835 15.263,836 9.089,837 26.105,838 12.558,839 1.916,840 6.262,841 23.075,842 3.172,843 13.954,844 16.702,845 9.966,846 28.504,847 13.692,848 1.133,849 5.412,850 24.943,851 2.652,852 15.081,853 18.014,854 10.76,855 30.845,856 14.791,857 0.429,858 2.893,859 26.817,860 2.232,861 16.233,862 19.429,863 11.613,864 33.229,865 15.919,866 -0.074,867 0.977,868 28.695,869 1.475,870 17.374,871 20.771,872 12.425,873 35.586,874 17.034,875 1196,876 2137,877 9.364,878 16.727,879 23.167,880 25.616,881 24.332,882 22.686,883 22.61,884 28.142,885 7.256,886 68.159,887 22.335,888 5.376,889 6.326,890 5.99,891 5.194,892 5.178,893 6.988,894 3.935,895 18.227,896 5.104,897 7.923,898 1.544,899 1.708,900 1.622,901 1.512,902 1.507,903 1.876,904 0.484,905 4.544,906 1.489,907 4.006,908 4.036,909 3.954,910 3.924,911 7.429,912 3.926,913 3.598,914 3.645,915 3.513,916 3.431,917 6.465,918 3.442,919 3.174,920 3.254,921 3.04,922 2.974,923 4.987,924 2.968,925 3.052,926 3.107,927 2.904,928 2.83,929 4.682,930 2.846,931 2.839,932 2.943,933 2.65,934 2.515,935 3.882,936 2.548,937 2.525,938 2.619,939 2.354,940 2.265,941 3.725,942 2.242,943 2.494,944 2.562,945 2.184,946 2.057,947 3.234,948 2.075,949 2.226,950 2.305,951 1.971,952 1.732,953 2.988,954 1.815,955 0.295,956 0.288,957 0.447,958 0.277,959 0.212,960 4.431,961 0.266,962 4.326,963 0.153,964 6.704,965 0.715,966 4.156,967 0.207,968 3.178,969 3.988,970 2.291,971 10.72,972 3.104,973 1.97,974 1.944,975 2.077,976 2.079,977 1.284,978 2.077,979 1.553,980 1.505,981 1.757,982 1.754,983 0.926,984 1.757,985 1.149,986 1.072,987 1.467,988 1.412,989 0.548,990 1.424,991 0.974,992 0.927,993 1.222,994 1.277,995 0.258,996 1.251,997 0.747,998 0.657,999 1.036,1000 1.128,1002 1.141,1003 0.52,1004 0.414,1005 0.938,1006 0.846,1008 0.873,1009 0.363,1010 0.256,1011 0.708,1012 0.784,1014 0.747,1015 0.091,1016 0.018,1017 0.582,1018 0.531,1020 0.562,1021 3.434,1022 4.779,1023 6.337,1024 7.995,1025 9.705,1026 1.962,1029 5.582,1030 9.495,1031 0.493,1033 -0.63,1034 0.642,1036 16.106,1037 41.973,1038 93.192,1039 108.702,1040 113.457,1041 113.457,1042 113.457,1043 25.368,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.922,1049 3,1050 2.322,1051 21.161,1052 30,1053 24,1054 0.41,1055 101.779,1056 174.96,1057 240.1,1058 1665,1060 10.293,1061 0.735,1062 0.564,1063 10.293,1064 7.897,1065 6.592,1066 0.439,1067 0.298,1068 4.413,1069 6.334,1070 4.278,1071 3.56,1072 6.592,1073 4.473,1074 6.273,1075 0.285,1076 0.163,1077 6.273,1078 3.593,1079 5.38,1080 0.186,1081 0.084,1082 5.38,1083 2.429,1084 4.086,1085 0.113,1086 0.047,1087 4.086,1088 1.684,1089 3.153,1090 0.07,1091 0.025,1092 3.153,1093 1.147,1094 0.585,1095 41.619,1096 0.327,1097 13.603,1098 1.302,1099 74,1100 224.843,1101 81.76,1102 218.436,1103 290.37,1104 200,1105 88,1106 213.902,1107 97.007,1108 215.051,1109 312.54,1110 201,1111 6.396}
{0 CHEMBL2049095,1 1.989,2 6.353,3 0.891,4 0.794,5 53.368,6 9.47,7 0.333,8 3.427,9 3.53,10 3.133,11 2.862,12 4.787,13 2.925,14 3.974,15 4.101,16 3.664,17 3.263,18 5.907,19 3.329,20 4.211,21 4.366,22 3.686,23 3.394,24 5.819,25 3.442,26 4.318,27 4.516,28 3.495,29 3.242,30 5.866,31 3.297,32 4.035,33 4.234,34 3.171,35 2.92,36 5.519,37 2.966,38 3.818,39 4.078,40 2.952,41 2.456,42 5.327,43 2.551,44 3.405,45 3.584,46 2.99,47 1.853,48 5.795,49 2.169,50 3.039,51 3.271,52 2.144,53 1.035,54 5.493,55 1.401,56 0.299,57 0.612,58 3.321,59 2.361,60 60.083,61 2.169,62 0.877,63 1.223,64 7.535,65 4.029,66 165.068,67 3.984,68 0.785,69 1.005,70 10.245,71 4.961,72 136.52,73 5.442,74 1.198,75 0.92,76 16.128,77 4.925,78 208.405,79 4.967,80 0.9,81 0.722,82 12.126,83 3.848,84 163.029,85 4.009,86 0.863,87 0.552,88 12.874,89 2.675,90 156.054,91 3.192,92 0.753,93 0.448,94 6.989,95 1.504,96 143.235,97 1.254,98 0.773,99 0.157,100 7.317,101 1.035,102 154.648,103 0.384,104 38,105 28,106 0.401,107 0.77,108 0.844,109 0.881,110 0.881,111 0.881,112 2.91,113 0.798,114 -2.96,115 -2.96,116 -2.86,117 38.5,119 1,123 1,125 1,128 3,129 2,130 1,135 1,137 5,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 4,153 1,155 3,158 1,159 4,160 1,161 1,163 1,165 2,168 3,171 2,173 1,177 1,179 1,194 254,195 10.472,196 10.472,197 10.472,198 10.472,199 10.472,200 9.705,201 13.731,202 5.701,203 10.806,204 8.81,205 8.81,206 8.81,207 8.81,208 8.81,209 7.473,210 14.019,211 2.664,212 9.401,213 2.712,214 0.885,215 0.52,216 0.337,217 0.337,218 0.337,219 3.546,221 218,222 3,223 77.068,224 66.181,226 1.08,227 44.978,228 0.83,229 1,230 0.8,231 0.5,232 0.88,233 41.5,234 108,235 4.528,236 4.461,237 7.122,238 4.242,239 3.343,240 4.058,241 3.825,242 11.728,243 3.126,244 4.281,245 4.325,246 6.692,247 4.057,248 3.126,249 3.492,250 2.291,251 10.65,252 2.813,253 3.717,254 3.326,255 5.833,256 3.391,257 2.405,258 2.953,259 1.257,260 7.701,261 2.34,262 3.148,263 2.87,264 5.199,265 2.99,266 2.027,267 2.247,268 0.08,269 6.076,270 1.948,271 2.917,272 2.058,273 4.577,274 2.496,275 1.56,276 2.035,278 4.569,279 1.418,280 2.463,281 1.832,282 3.921,283 2.095,284 1.109,285 1.439,286 2.885,287 1.087,288 1.854,289 1.468,290 3.204,291 1.452,292 0.397,293 0.512,294 0.914,295 0.413,296 1.107,297 0.51,298 2.884,299 0.873,300 -0.106,301 -0.122,302 -0.276,303 -0.104,304 0.732,305 0.51,306 2.69,307 0.369,308 -0.608,309 -0.734,310 -1.64,311 -0.59,312 0.326,313 0.503,314 2.179,315 -0.016,316 -1,317 -1,318 -2.853,319 -0.7,321 -0.079,322 2,323 -0.247,324 -1,325 -1,326 -3,327 -0.7,329 -0.248,330 2,331 -0.3,332 -1,333 -1.259,335 -3,336 -0.982,338 -0.791,339 1.728,340 -0.3,341 -1.285,342 -1.525,343 -0.67,344 -3.293,345 -1.311,346 -0.418,347 -0.953,348 1.638,349 -0.535,350 -1.505,351 -1.706,352 -0.805,353 -4.735,354 -1.477,355 -0.5,356 -1.152,357 1.32,358 -0.622,359 -1.582,360 -1.884,361 -1.313,362 -5.217,363 -1.514,364 7.324,365 0.431,366 0.782,367 0.046,368 19,369 1.118,370 8,371 0.471,372 11,373 0.647,374 12.372,375 0.728,376 20.276,377 0.78,378 15.449,379 0.909,380 4.015,381 0.236,382 3.788,383 0.223,384 0.263,385 0.068,386 0.396,387 3,389 0.643,390 0.898,391 0.613,392 0.927,393 0.714,394 0.817,395 0.427,396 0.742,397 0.552,398 1.014,399 0.435,400 0.942,401 0.602,402 0.899,403 0.732,404 1.217,405 0.562,406 1.145,407 1.163,408 0.943,409 1.213,410 1.001,411 1.101,412 1.085,413 1.147,414 1.076,415 1.194,416 1.183,417 1.124,418 1.227,419 1.257,420 1.01,421 1.097,422 0.803,423 1.433,424 0.81,425 1.36,426 1.532,427 1.031,428 1.001,429 1.381,430 0.854,431 2.732,432 1.621,433 2.37,434 0.036,435 2.593,436 0.459,437 5.5,439 3.111,440 1.75,441 1.449,442 0.667,443 0.469,444 0.177,447 1892,448 9904,449 1.882,450 34.6,452 4,454 3,455 2,456 1.574,457 1.659,458 2.692,459 1.366,461 1,462 51.708,463 1.989,464 3.815,465 4.181,466 4.364,467 4.364,468 4.364,469 2.205,470 3.264,471 4.062,472 2.799,473 380.61,474 6.888,475 3333.57,476 122.211,477 1.792,478 3.933,479 0.306,481 0.111,482 0.06,483 0.066,484 0.044,485 0.043,486 0.018,489 0.648,490 0.67,491 1.011,492 68.419,493 -0.059,494 0.022,495 -0.037,496 0.167,497 -0.133,498 0.121,499 0.358,500 0.317,501 0.169,502 0.073,503 0.345,504 0.006,505 0.04,506 -0.145,507 0.044,508 -0.226,509 0.082,510 -0.147,511 -0.266,512 -0.132,513 -0.231,514 -0.086,515 -0.201,516 -0.104,517 -0.244,518 -0.285,519 -0.184,520 -0.256,521 -0.237,522 -0.215,523 -0.119,524 -0.033,525 0.149,526 0.062,527 -0.301,528 0.215,529 0.356,530 -0.02,531 0.248,532 -0.13,533 0.328,534 -0.099,535 -0.266,536 0.384,537 -0.664,538 0.843,539 -0.047,540 0.271,541 5.707,542 4.455,543 0.588,544 9.467,545 1.07,546 1.173,547 1.726,548 2.978,549 0.636,550 2.944,551 3.367,552 3.584,553 3.761,554 4.007,555 4.111,556 4.174,557 4.007,558 3.912,559 3.178,560 4.018,561 0.664,562 246.21,563 2.944,564 4.533,565 5.389,566 6.301,567 7.18,568 8.09,569 8.977,570 9.885,571 10.777,572 11.683,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 18,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,600 1,601 2,602 7,603 3,605 1,606 1,608 1,610 1,611 3,612 9,613 7,614 3,615 7,617 2,619 2,620 2,621 1,625 1,626 1,627 1,630 3,631 17,632 1,633 1,635 1,636 1,637 1,638 3,639 7.7,640 1,642 1,645 10.25,646 4.412,647 3.528,648 1.344,649 1.354,650 1.221,651 0.925,652 2.7,653 7.477,654 3.135,655 3.726,656 4.223,657 4.676,658 5.211,659 5.445,660 5.712,661 5.687,662 5.605,663 5.062,664 1,665 29,666 6.756,668 3.504,669 9.015,670 10.851,672 9.053,674 3.515,675 59.75,677 70.627,678 52.555,679 32.897,681 67.951,682 44.88,683 52.555,684 138.577,685 77.778,687 35.432,688 71.234,689 29.85,690 54.008,692 70.627,693 7.76,694 70.627,695 85.453,696 112.831,698 47.084,699 93.567,700 42.806,701 43.191,702 42.261,704 115.507,705 100.848,706 52.555,707 78.386,708 16.367,709 28.429,710 145.728,711 70.627,712 145.728,713 52.555,714 0.622,715 0.354,716 0.16,717 0.088,718 15,719 8,722 1,723 1.2,724 2.696,725 121.177,726 0.2,727 10,728 64.732,729 12.052,730 3.808,731 2.048,732 145.728,733 2.763,734 -0.578,735 75.703,736 268.91,737 22,738 11.298,740 -0.725,741 27.814,742 30.511,743 0.423,744 0.812,745 0.889,746 0.928,747 0.928,748 0.928,749 4.449,750 -0.106,751 5.493,752 0.914,753 4.043,754 4.407,755 3.483,756 6.412,757 3.93,758 5.708,759 -0.608,760 7.151,761 -0.276,762 4.111,763 4.494,764 4.035,765 7.73,766 3.829,767 7.065,768 -1,769 8.916,770 -1.64,771 5.832,772 6.563,773 5.585,774 10.729,775 5.579,776 8.452,777 -1,778 10.738,779 -2.853,780 6.594,781 7.334,782 6.75,783 12.738,784 6.176,785 9.866,786 -1,787 12.593,788 -3,789 7.943,790 9.016,791 8.111,792 15.365,793 7.518,794 11.298,795 -1.285,796 14.471,797 -3,798 8.965,799 10.083,800 9.413,801 17.631,802 8.406,803 12.744,804 -1.505,805 16.364,806 -3.293,807 10.201,808 11.614,809 10.752,810 20.137,811 9.603,812 3.343,813 -1.582,814 18.268,815 -4.735,816 11.322,817 12.826,818 12.084,819 22.504,820 10.617,821 3.126,822 11.728,823 20.18,824 -5.217,825 12.521,826 14.288,827 13.423,828 24.968,829 11.761,830 2.405,831 10.65,832 22.099,833 4.058,834 13.682,835 15.577,836 14.761,837 27.378,838 12.832,839 2.027,840 7.701,841 24.024,842 3.492,843 14.871,844 17.005,845 16.102,846 29.828,847 13.959,848 1.56,849 6.076,850 25.953,851 2.953,852 16.048,853 18.339,854 17.442,855 32.257,856 15.057,857 1.109,858 4.569,859 27.886,860 2.247,861 17.236,862 19.75,863 18.784,864 34.703,865 16.179,866 0.397,867 2.885,868 29.821,869 2.035,870 18.42,871 21.109,872 20.125,873 37.141,874 17.291,875 2033,876 4711,877 10.751,878 16.54,879 28.705,880 30.282,881 29.541,882 28.225,883 27.934,884 33.473,885 14.906,886 89.046,887 26.29,888 5.474,889 6.461,890 6.375,891 5.281,892 5.343,893 7.058,894 5.47,895 19.253,896 5.126,897 11.362,898 1.595,899 1.682,900 1.641,901 1.568,902 1.552,903 1.86,904 0.828,905 4.947,906 1.461,907 4.015,908 4.042,909 3.976,910 3.924,911 8.513,912 3.93,913 3.627,914 3.668,915 3.595,916 3.429,917 7.999,918 3.453,919 3.26,920 3.318,921 3.241,922 2.967,923 7.999,924 3.015,925 3.099,926 3.139,927 3.008,928 2.827,929 7.429,930 2.861,931 2.85,932 2.952,933 2.686,934 2.514,935 6.465,936 2.557,937 2.561,938 2.634,939 2.471,940 2.255,941 4.987,942 2.302,943 2.511,944 2.577,945 2.272,946 2.056,947 4.627,948 2.076,949 2.243,950 2.315,951 2.003,952 1.732,953 3.744,954 1.821,955 0.252,956 0.248,957 0.396,958 0.236,959 0.186,960 4.528,961 0.225,962 4.461,963 0.213,964 7.122,965 0.652,966 4.242,967 0.174,968 3.343,969 4.058,970 3.825,971 11.728,972 3.126,973 1.964,974 1.941,975 2.054,976 2.08,977 1.276,978 2.07,979 1.536,980 1.496,981 1.7,982 1.759,983 0.87,984 1.733,985 1.075,986 1.028,987 1.234,988 1.423,989 0.287,990 1.347,991 0.948,992 0.91,993 1.161,994 1.286,995 0.182,996 1.224,997 0.73,998 0.65,999 0.967,1000 1.13,1002 1.117,1003 0.476,1004 0.369,1005 0.841,1006 0.846,1008 0.859,1009 0.334,1010 0.249,1011 0.633,1012 0.787,1014 0.735,1015 0.084,1016 0.012,1017 0.53,1018 0.533,1020 0.548,1021 3.611,1022 5.004,1023 6.589,1024 8.259,1025 9.972,1028 37.364,1029 5.41,1030 9.417,1031 -0.019,1033 -1.018,1034 0.295,1035 -4.457,1036 17.256,1037 51.708,1038 99.192,1039 108.702,1040 113.457,1041 113.457,1042 113.457,1043 50.921,1044 6.122,1045 66.56,1046 66.56,1047 12,1048 12.203,1049 3,1050 2.322,1051 28.302,1052 42,1053 30,1054 0.368,1055 105.373,1056 193.17,1057 248.87,1058 2649,1059 11.5,1060 12.793,1061 0.753,1062 0.502,1063 10.293,1064 8.53,1065 7.804,1066 0.434,1067 0.266,1068 4.654,1069 7.249,1070 4.64,1071 3.764,1072 6.592,1073 4.79,1074 8.231,1075 0.294,1076 0.136,1077 6.273,1078 3.802,1079 6.343,1080 0.181,1081 0.074,1082 5.38,1083 2.601,1084 4.638,1085 0.11,1086 0.041,1087 4.086,1088 1.732,1089 3.625,1090 0.067,1091 0.022,1092 3.153,1093 1.187,1094 0.541,1095 51.137,1096 0.305,1097 16.516,1098 1.118,1099 92,1100 501.176,1101 116.777,1102 398.09,1103 497.85,1104 362,1105 109,1106 337.902,1107 128.483,1108 318.152,1109 485.01,1110 297,1111 6.312}
{0 CHEMBL2049096,1 1.869,2 5.071,3 0.154,4 0.024,5 47.611,6 8.53,7 0.4,8 3.292,9 3.402,10 2.933,11 2.764,12 4.618,13 2.794,14 3.77,15 3.906,16 3.33,17 3.157,18 5.076,19 3.178,20 4.103,21 4.274,22 3.498,23 3.256,24 5.639,25 3.287,26 4.111,27 4.304,28 3.253,29 3.055,30 5.604,31 3.083,32 3.834,33 4.045,34 2.851,35 2.682,36 5.5,37 2.674,38 3.392,39 3.684,40 1.969,41 2.049,42 4.997,43 1.939,44 2.356,45 2.72,46 0.351,47 1.113,48 3.091,49 0.846,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.165,57 0.412,58 3.918,59 1.957,60 24.313,61 2.162,62 0.239,63 0.649,64 6.809,65 3.317,66 35.887,67 3.885,68 0.517,69 0.787,70 11.699,71 4.26,72 92.262,73 5.051,74 0.686,75 0.707,76 13.74,77 3.842,78 107.651,79 4.281,80 0.62,81 0.492,82 11.239,83 2.995,84 106.049,85 3.553,86 0.453,87 0.251,88 8.822,89 1.916,90 82.754,91 2.629,92 0.105,93 0.05,94 3.391,95 0.675,96 17.887,97 1.236,98 0.019,99 0.007,100 0.784,101 0.143,102 3.071,103 0.3,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.834,114 -2.37,115 -2.41,116 -2.36,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 2,142 1,143 3,144 1,146 3,148 2,149 3,150 3,151 3,153 1,155 3,158 1,159 2,160 1,161 1,165 1,168 3,171 2,173 1,177 1,179 1,194 128,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 9.553,202 5.086,203 9.186,204 7.32,205 7.32,206 7.32,207 7.32,208 7.32,209 5.912,210 8.428,211 2.352,212 7.532,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 28.529,228 0.67,229 0.83,230 0.8,232 0.76,233 32.5,234 71,235 4.484,236 4.328,237 6.793,238 4.19,239 3.216,240 4.074,241 2.291,242 11.048,243 3.126,244 3.89,245 3.327,246 6.045,247 3.568,248 2.588,249 3.158,250 1.257,251 8.297,252 2.528,253 3.336,254 3.211,255 5.423,256 3.096,257 2.138,258 2.529,259 0.08,260 6.522,261 2.039,262 2.926,263 2.257,264 4.549,265 2.542,266 1.563,267 2.078,269 4.289,270 1.52,271 2.635,272 1.985,273 3.857,274 2.304,275 1.327,276 1.646,278 3.061,279 1.287,280 1.835,281 1.468,282 3.153,283 1.43,284 0.373,285 0.482,286 0.847,287 0.388,288 1.319,289 0.921,290 2.848,291 1.075,292 0.136,293 0.153,294 0.329,295 0.125,296 0.825,297 0.148,298 2.346,299 0.434,300 -0.506,301 -0.628,302 -1.175,303 -0.464,304 0.334,305 -0.2,306 1.866,307 0.073,308 -0.891,309 -1.003,310 -2.337,311 -0.853,313 -0.57,314 1.729,315 -0.253,316 -1.293,317 -1.512,318 -3.341,319 -1.212,320 -0.071,321 -0.881,322 1.37,323 -0.439,324 -1.348,325 -1.798,326 -3.41,327 -1.357,328 -0.455,329 -1.144,330 1.258,331 -0.58,332 -1.536,333 -1.805,335 -4.669,336 -1.482,337 -0.5,338 -1.51,339 1.204,340 -0.802,341 -1.768,342 -2.147,343 -0.67,344 -5.415,345 -1.699,346 -0.611,347 -1.669,348 1.088,349 -1,350 -2,351 -2.227,352 -1.313,353 -6.48,354 -1.947,355 -0.946,356 -2,357 0.472,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.566,363 -2,364 6.252,365 0.447,366 0.477,367 0.034,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 8.961,375 0.64,376 15.948,377 0.693,378 11.364,379 0.812,380 3.555,381 0.254,382 3.054,383 0.218,384 0.216,386 0.464,388 1,389 0.67,390 0.919,391 0.698,392 0.859,393 0.709,394 0.801,395 0.609,396 1.119,397 0.673,398 1.138,399 0.614,400 0.984,401 0.836,402 1.11,403 0.838,404 1.133,405 0.821,406 1.021,407 1.424,408 1.053,409 1.283,410 1.031,411 1.435,412 1.081,413 1.29,414 1.026,415 1.279,416 1.058,417 1.241,418 1.152,419 1.184,420 0.884,421 1.248,422 0.769,423 1.191,424 0.957,425 0.478,426 0.234,427 0.778,428 0.471,429 0.576,430 0.68,437 3,439 2.444,440 1.375,441 1.289,442 0.347,443 0.08,447 1077,448 4387,449 1.952,450 39.1,452 4,454 3,455 2,456 1.518,457 1.75,458 2.425,459 1.453,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.577,470 2.646,471 3.787,472 2.396,473 217.998,474 6.35,475 1695.46,476 104.042,477 1.557,478 3.689,479 0.2,481 0.111,482 0.057,483 0.076,484 0.035,485 0.027,489 0.506,490 0.67,491 0.788,492 50.776,493 -0.045,494 0.095,495 -0.028,496 0.203,497 -0.115,498 0.124,499 0.013,500 -0.13,501 0.054,502 -0.08,503 -0.013,504 -0.017,505 0.032,506 -0.154,507 0.044,508 -0.163,509 0.053,510 -0.081,511 -0.251,512 -0.044,513 -0.274,514 -0.121,515 -0.247,516 -0.187,517 -0.055,518 -0.037,519 -0.198,520 -0.145,521 -0.019,522 -0.221,523 0.034,524 0.098,525 -0.008,526 0.113,527 0.066,528 0.068,529 0.123,530 0.081,531 0.485,532 0.353,533 0.044,534 0.522,535 0.469,536 0.184,537 1.447,538 0.846,539 0.393,540 1.39,541 2.275,542 5.24,543 0.714,544 5.878,545 1.039,546 1.149,547 1.142,548 1.305,549 0.648,550 2.773,551 3.135,552 3.434,553 3.638,554 3.85,555 3.784,556 3.638,557 3.401,558 3.296,559 2.565,560 3.229,561 0.651,562 196.2,563 2.773,564 4.317,565 5.187,566 6.08,567 6.969,568 7.864,569 8.757,570 9.653,571 10.547,572 11.443,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,611 1,612 9,613 5,614 3,615 5,617 2,619 2,620 2,621 1,625 1,626 1,627 1,630 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.056,648 1.217,649 1.384,650 1.241,651 0.926,652 2.077,653 7.137,654 2.996,655 3.57,656 4.107,657 4.558,658 5.041,659 5.121,660 5.198,661 5.276,662 5.269,663 4.699,664 0.5,665 24,666 5.211,667 0.002,668 2.38,669 8.536,670 9.249,671 0.001,672 7.69,673 -0.001,674 3.036,675 42.5,676 0.002,677 70.627,678 50.731,679 32.897,681 67.951,682 14.96,683 50.731,684 138.577,685 47.857,687 35.432,688 71.234,689 29.85,690 15.063,691 14.96,692 70.627,694 70.627,695 83.628,696 82.911,698 62.045,699 48.687,700 42.806,701 35.432,702 48.197,704 85.587,705 100.848,706 50.731,707 70.627,708 22.303,709 28.429,710 115.808,711 70.627,712 115.808,713 50.731,714 0.602,715 0.375,716 0.189,717 0.102,718 12,719 6,722 1,723 1.2,724 2.466,725 92.121,726 0.2,727 10,728 53.303,729 9.276,730 3.134,731 1.353,732 115.808,733 4.179,734 0.003,735 75.703,736 237.166,737 19,738 11.228,740 -0.608,741 23.905,742 26.416,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.506,751 5.22,752 0.329,753 3.807,754 4.248,755 2.543,756 6.094,757 3.751,758 5.473,759 -0.891,760 6.838,761 -1.175,762 3.611,763 4.182,764 2.078,765 7.13,766 3.507,767 6.797,768 -1.293,769 8.557,770 -2.337,771 5.468,772 6.392,773 3.726,774 10.259,775 5.358,776 8.156,777 -1.348,778 10.33,779 -3.341,780 6.043,781 7.091,782 3.934,783 12.063,784 5.888,785 9.545,786 -1.536,787 12.136,788 -3.41,789 7.442,790 8.848,791 5.161,792 14.743,793 7.277,794 10.956,795 -1.768,796 13.962,797 -4.669,798 8.35,799 9.894,800 5.695,801 16.871,802 8.145,803 12.384,804 -2,805 15.805,806 -5.415,807 9.589,808 11.47,809 6.718,810 19.386,811 9.366,812 3.216,813 -2,814 17.659,815 -6.48,816 10.64,817 12.686,818 7.405,819 21.661,820 10.382,821 2.588,822 11.048,823 19.522,824 -7.566,825 11.824,826 14.178,827 8.33,828 24.109,829 11.544,830 2.138,831 8.297,832 21.393,833 4.074,834 12.937,835 15.481,836 9.089,837 26.451,838 12.625,839 1.563,840 6.522,841 23.27,842 3.158,843 14.104,844 16.931,845 9.966,846 28.872,847 13.766,848 1.327,849 4.289,850 25.152,851 2.529,852 15.245,853 18.28,854 10.76,855 31.246,856 14.876,857 0.373,858 3.061,859 27.039,860 2.078,861 16.408,862 19.708,863 11.613,864 33.655,865 16.012,866 0.136,867 0.847,868 28.929,869 1.646,870 17.562,871 21.083,872 12.425,873 36.043,874 17.136,875 1167,876 2400,877 9.364,878 14.904,879 23.117,880 25.967,881 24.437,882 22.787,883 22.683,884 28.241,885 7.256,886 68.785,887 22.028,888 5.43,889 6.328,890 6.321,891 5.229,892 5.216,893 7.074,894 3.935,895 18.614,896 5.126,897 7.799,898 1.541,899 1.731,900 1.629,901 1.519,902 1.512,903 1.883,904 0.484,905 4.586,906 1.469,907 4,908 4.028,909 3.959,910 3.902,911 8.201,912 3.909,913 3.564,914 3.609,915 3.492,916 3.389,917 7.429,918 3.403,919 3.142,920 3.195,921 3.052,922 2.872,923 6.465,924 2.906,925 2.892,926 2.987,927 2.75,928 2.677,929 4.985,930 2.684,931 2.762,932 2.805,933 2.685,934 2.47,935 4.585,936 2.514,937 2.524,938 2.605,939 2.313,940 2.066,941 3.748,942 2.083,943 2.309,944 2.377,945 2.078,946 1.758,947 3.439,948 1.855,949 1.73,950 1.887,951 1.534,952 1.254,953 2.895,954 1.235,955 0.299,956 0.289,957 0.453,958 0.279,959 0.214,960 4.484,961 0.272,962 4.328,963 0.153,964 6.793,965 0.737,966 4.19,967 0.208,968 3.216,969 4.074,970 2.291,971 11.048,972 3.126,973 1.947,974 1.922,975 2.039,976 2.071,977 1.257,978 2.059,979 1.508,980 1.462,981 1.697,982 1.712,983 0.829,984 1.707,985 1,986 0.958,987 1.195,988 1.354,989 0.23,990 1.287,991 0.838,992 0.762,993 1.127,994 1.154,995 0.131,996 1.174,997 0.647,998 0.593,999 0.904,1000 0.942,1002 0.931,1003 0.395,1004 0.266,1005 0.753,1006 0.838,1008 0.789,1009 0.112,1010 0.047,1011 0.581,1012 0.62,1014 0.616,1017 0.3,1018 0.192,1020 0.244,1021 3.434,1022 4.779,1023 6.347,1024 8.019,1025 9.743,1028 13.24,1029 5.435,1030 9.362,1031 0.123,1033 -0.871,1034 0.409,1036 14.963,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 33.03,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.968,1049 3,1050 2.322,1051 21.084,1052 29,1053 18,1054 0.425,1055 93.384,1056 163.73,1057 219.618,1058 1663,1059 4.3,1060 10.293,1061 0.735,1062 0.52,1063 9.422,1064 7.274,1065 6.609,1066 0.441,1067 0.278,1068 4.083,1069 6.239,1070 4.043,1071 3.31,1072 6.198,1073 4.168,1074 6.167,1075 0.28,1076 0.145,1077 5.64,1078 3.198,1079 5.524,1080 0.184,1081 0.076,1082 5.045,1083 2.272,1084 4.138,1085 0.112,1086 0.041,1087 3.821,1088 1.531,1089 3.292,1090 0.072,1091 0.022,1092 2.954,1093 1.03,1094 0.598,1095 42.586,1096 0.327,1097 13.497,1098 1.382,1099 74,1100 310.954,1101 85.59,1102 271.47,1103 349.75,1104 248,1105 89,1106 248.236,1107 101.499,1108 240.573,1109 352.77,1110 226,1111 5.686}
{0 CHEMBL2049097,1 1.869,2 5.071,3 0.613,4 0.376,5 52.199,6 9.246,7 0.4,8 3.285,9 3.388,10 3.003,11 2.821,12 4.552,13 2.821,14 3.761,15 3.889,16 3.423,17 3.233,18 4.983,19 3.214,20 4.09,21 4.25,22 3.618,23 3.37,24 5.549,25 3.339,26 4.092,27 4.267,28 3.419,29 3.207,30 5.477,31 3.153,32 3.812,33 4.003,34 3.106,35 2.846,36 5.255,37 2.762,38 3.365,39 3.635,40 2.233,41 2.222,42 4.692,43 2.031,44 2.356,45 2.72,46 0.351,47 1.113,48 3.091,49 0.846,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.142,57 0.334,58 3.482,59 1.88,60 16.473,61 2.121,62 0.189,63 0.519,64 6.349,65 3.316,66 22.159,67 3.951,68 0.429,69 0.624,70 12.483,71 4.614,72 68.964,73 5.476,74 0.539,75 0.528,76 16.861,77 4.512,78 71.411,79 4.953,80 0.458,81 0.363,82 14.311,83 3.6,84 61.184,85 4.043,86 0.316,87 0.206,88 12.746,89 2.528,90 42.681,91 3.245,92 0.091,93 0.073,94 3.795,95 0.849,96 14.36,97 1.314,98 0.016,99 0.012,100 0.94,101 0.189,102 2.29,103 0.33,104 17,105 22,106 0.389,107 0.794,108 0.862,109 0.905,110 0.905,111 0.905,112 2.737,113 0.909,114 -2.52,115 -2.55,116 -2.49,117 39.1,119 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 2,142 1,143 5,144 1,146 3,148 2,149 3,150 3,151 5,153 1,155 4,158 1,159 2,160 1,161 2,165 1,168 5,171 3,173 2,177 1,179 1,194 128,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 9.532,202 5.086,203 9.245,204 7.32,205 7.32,206 7.32,207 7.32,208 7.32,209 5.912,210 8.405,211 2.352,212 7.658,213 2.655,214 0.707,215 0.381,216 0.174,217 0.174,218 0.174,219 3.369,220 1,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 22.248,228 0.83,229 1,230 0.8,232 0.8,233 31.333,234 71,235 4.484,236 4.328,237 6.793,238 4.185,239 3.216,240 4.074,241 2.291,242 11.048,243 3.107,244 3.89,245 3.327,246 6.045,247 3.551,248 2.588,249 3.158,250 1.257,251 8.297,252 2.478,253 3.336,254 3.223,255 5.423,256 3.086,257 2.138,258 2.529,259 0.08,260 6.522,261 2.004,262 2.926,263 2.271,264 4.549,265 2.524,266 1.563,267 2.078,269 4.289,270 1.474,271 2.635,272 1.986,273 3.857,274 2.29,275 1.327,276 1.646,278 3.061,279 1.233,280 1.835,281 1.468,282 3.153,283 1.429,284 0.373,285 0.482,286 0.847,287 0.387,288 1.319,289 0.929,290 2.848,291 1.039,292 0.136,293 0.153,294 0.329,295 0.109,296 0.825,297 0.154,298 2.346,299 0.389,300 -0.506,301 -0.628,302 -1.175,303 -0.394,304 0.334,305 -0.196,306 1.866,307 0.064,308 -0.891,309 -1.003,310 -2.337,311 -0.834,313 -0.568,314 1.729,315 -0.253,316 -1.293,317 -1.512,318 -3.341,319 -1.097,320 -0.071,321 -0.881,322 1.37,323 -0.514,324 -1.348,325 -1.798,326 -3.41,327 -1.352,328 -0.455,329 -1.141,330 1.258,331 -0.617,332 -1.536,333 -1.805,335 -4.669,336 -1.48,337 -0.5,338 -1.51,339 1.204,340 -0.835,341 -1.768,342 -2.147,343 -0.67,344 -5.415,345 -1.689,346 -0.611,347 -1.669,348 1.088,349 -1,350 -2,351 -2.227,352 -1.313,353 -6.48,354 -1.947,355 -0.946,356 -2,357 0.472,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.566,363 -2,364 6.681,365 0.477,366 0.477,367 0.034,368 17,369 1.214,370 8,371 0.571,372 9,373 0.643,374 9.679,375 0.691,376 15.519,377 0.675,378 10.646,379 0.76,380 3.424,381 0.245,382 3.185,383 0.227,384 0.267,386 0.434,389 0.728,390 1.014,391 0.57,392 0.69,393 0.807,394 0.725,395 0.608,396 1.242,397 0.586,398 0.926,399 0.624,400 0.892,401 0.805,402 1.094,403 0.816,404 0.98,405 0.768,406 0.964,407 1.446,408 0.993,409 1.313,410 1.091,411 1.421,412 1.119,413 1.33,414 1.003,415 1.306,416 1.2,417 1.291,418 1.192,419 1.031,420 0.751,421 1.549,422 1.226,423 1.041,424 1.158,425 0.649,426 0.378,427 0.465,428 0.427,429 0.869,430 0.633,437 3,439 2.444,440 1.375,441 1.289,442 0.347,443 0.08,447 1077,448 4387,449 1.952,450 39.1,452 4,454 3,455 2,456 1.518,457 1.75,458 2.425,459 1.453,461 1,462 42.983,463 1.869,464 3.816,465 4.143,466 4.35,467 4.35,468 4.35,469 1.577,470 2.646,471 3.787,472 2.396,473 217.998,474 6.35,475 1695.46,476 104.042,477 1.557,478 3.689,479 0.2,481 0.111,482 0.057,483 0.076,484 0.035,485 0.027,489 0.506,490 0.67,491 0.788,492 50.776,493 -0.04,494 0.22,495 -0.025,496 0.208,497 -0.148,498 0.119,499 0.031,500 -0.091,501 0.046,502 -0.001,503 -0.019,504 0.011,505 0.09,506 -0.067,507 0.022,508 -0.049,509 0.145,510 -0.045,511 -0.27,512 -0.081,513 -0.229,514 -0.135,515 -0.221,516 -0.2,517 -0.123,518 -0.183,519 -0.114,520 -0.208,521 -0.11,522 -0.217,523 0.028,524 -0.052,525 -0.113,526 -0.184,527 0.02,528 -0.046,529 0.104,530 0.28,531 0.408,532 0.499,533 -0.012,534 0.577,535 0.534,536 0.494,537 1.038,538 1.012,539 0.443,540 1.426,541 2.167,542 4.307,543 0.714,544 5.878,545 1.031,546 1.131,547 1.292,548 1.671,549 0.688,550 2.773,551 3.135,552 3.434,553 3.638,554 3.85,555 3.784,556 3.638,557 3.401,558 3.296,559 2.565,560 3.229,561 0.67,562 212.65,563 2.773,564 4.317,565 5.187,566 6.08,567 6.969,568 7.864,569 8.757,570 9.653,571 10.547,572 11.443,573 8.7,574 1,578 1,579 3,580 3,582 1,585 1,586 23,587 7,588 15,589 24,590 9,591 3,592 3,594 2,595 3,596 1,598 2,601 2,602 7,603 2,605 1,606 1,608 1,610 1,612 9,613 4,614 3,615 5,616 1,617 2,619 2,620 2,621 1,625 1,626 1,627 1,629 1,631 14,632 1,633 1,635 1,636 1,638 1,639 8.7,640 1,642 1,645 8,646 3.876,647 3.056,648 1.217,649 1.384,650 1.241,651 0.927,652 2.286,653 7.137,654 2.996,655 3.57,656 4.107,657 4.558,658 5.041,659 5.121,660 5.198,661 5.276,662 5.269,663 4.699,664 0.5,665 24,666 5.163,667 0.002,668 2.293,669 8.258,670 9.389,671 0.001,672 7.798,673 -0.001,674 2.758,675 38.611,676 0.002,677 70.627,678 45.111,679 32.897,680 39.149,681 67.951,683 45.111,684 177.726,685 32.897,687 35.432,688 71.234,689 29.85,690 9.443,692 70.627,693 39.149,694 70.627,695 78.008,696 67.951,697 39.149,698 47.084,699 48.687,700 42.806,701 35.432,702 42.576,703 39.149,704 70.627,705 100.848,706 84.259,707 70.627,708 16.682,709 28.429,710 139.996,711 70.627,712 100.848,713 84.259,714 0.602,715 0.375,716 0.189,717 0.102,718 12,719 6,722 1,723 1.2,724 2.466,725 92.121,726 0.2,727 10,728 53.303,729 9.614,730 3.329,731 1.459,732 100.848,733 5.01,734 1.65,735 75.703,736 255.734,737 19,738 11.307,740 -0.5,741 23.716,742 26.02,743 0.413,744 0.844,745 0.916,746 0.962,747 0.962,748 0.962,749 4.256,750 -0.506,751 5.22,752 0.329,753 3.807,754 4.248,755 2.543,756 6.094,757 3.723,758 5.473,759 -0.891,760 6.838,761 -1.175,762 3.611,763 4.182,764 2.078,765 7.13,766 3.451,767 6.797,768 -1.293,769 8.557,770 -2.337,771 5.468,772 6.392,773 3.726,774 10.259,775 5.317,776 8.156,777 -1.348,778 10.33,779 -3.341,780 6.043,781 7.091,782 3.934,783 12.063,784 5.826,785 9.545,786 -1.536,787 12.136,788 -3.41,789 7.442,790 8.848,791 5.161,792 14.743,793 7.224,794 10.956,795 -1.768,796 13.962,797 -4.669,798 8.35,799 9.894,800 5.695,801 16.871,802 8.078,803 12.384,804 -2,805 15.805,806 -5.415,807 9.589,808 11.47,809 6.718,810 19.386,811 9.303,812 3.216,813 -2,814 17.659,815 -6.48,816 10.64,817 12.686,818 7.405,819 21.661,820 10.31,821 2.588,822 11.048,823 19.522,824 -7.566,825 11.824,826 14.178,827 8.33,828 24.109,829 11.47,830 2.138,831 8.297,832 21.393,833 4.074,834 12.937,835 15.481,836 9.089,837 26.451,838 12.545,839 1.563,840 6.522,841 23.27,842 3.158,843 14.104,844 16.931,845 9.966,846 28.872,847 13.683,848 1.327,849 4.289,850 25.152,851 2.529,852 15.245,853 18.28,854 10.76,855 31.246,856 14.788,857 0.373,858 3.061,859 27.039,860 2.078,861 16.408,862 19.708,863 11.613,864 33.655,865 15.92,866 0.136,867 0.847,868 28.929,869 1.646,870 17.562,871 21.083,872 12.425,873 36.043,874 17.039,875 1167,876 2400,877 9.364,878 15.824,879 23.117,880 25.991,881 24.437,882 22.864,883 22.683,884 28.241,885 7.256,886 68.785,887 21.585,888 5.43,889 6.328,890 6.321,891 5.224,892 5.216,893 7.074,894 3.935,895 18.614,896 5.107,897 7.799,898 1.541,899 1.733,900 1.629,901 1.524,902 1.512,903 1.883,904 0.484,905 4.586,906 1.439,907 3.996,908 4.022,909 4.054,910 3.916,911 7.429,912 3.917,913 3.561,914 3.604,915 3.6,916 3.394,917 6.465,918 3.407,919 3.137,920 3.186,921 3.27,922 2.913,923 4.998,924 2.923,925 2.889,926 2.983,927 2.924,928 2.677,929 4.888,930 2.684,931 2.746,932 2.775,933 2.74,934 2.515,935 4.307,936 2.54,937 2.52,938 2.596,939 2.365,940 2.086,941 3.746,942 2.093,943 2.301,944 2.364,945 2.213,946 1.774,947 3.325,948 1.863,949 1.708,950 1.868,951 1.88,952 1.409,953 2.816,954 1.339,955 0.299,956 0.289,957 0.453,958 0.279,959 0.214,960 4.484,961 0.272,962 4.328,963 0.153,964 6.793,965 0.737,966 4.185,967 0.207,968 3.216,969 4.074,970 2.291,971 11.048,972 3.107,973 1.949,974 1.927,975 2.032,976 2.06,977 1.264,978 2.054,979 1.509,980 1.464,981 1.694,982 1.702,983 0.834,984 1.704,985 1.005,986 0.968,987 1.189,988 1.344,989 0.24,990 1.281,991 0.838,992 0.762,993 1.122,994 1.148,995 0.134,996 1.172,997 0.654,998 0.61,999 0.892,1000 0.889,1002 0.91,1003 0.398,1004 0.272,1005 0.741,1006 0.826,1008 0.783,1009 0.114,1010 0.051,1011 0.573,1012 0.584,1014 0.603,1017 0.299,1018 0.181,1020 0.241,1021 3.434,1022 4.779,1023 6.347,1024 8.019,1025 9.743,1027 5.916,1029 5.543,1030 9.47,1031 0.366,1033 -0.715,1034 0.565,1036 15.407,1037 42.983,1038 87.777,1039 95.287,1040 100.042,1041 100.042,1042 100.042,1043 27.469,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.968,1049 3,1050 2.322,1051 21.084,1052 29,1053 18,1054 0.425,1055 100.519,1056 172.87,1057 237.027,1058 1663,1059 4.3,1060 10.293,1061 0.735,1062 0.574,1063 10.793,1064 8.03,1065 6.609,1066 0.441,1067 0.303,1068 4.138,1069 6.059,1070 4.043,1071 3.31,1072 6.898,1073 4.546,1074 6.167,1075 0.28,1076 0.164,1077 6.538,1078 3.605,1079 5.524,1080 0.184,1081 0.088,1082 5.882,1083 2.626,1084 4.138,1085 0.112,1086 0.048,1087 4.431,1088 1.777,1089 3.292,1090 0.072,1091 0.027,1092 3.594,1093 1.221,1094 0.598,1095 44.895,1096 0.327,1097 13.497,1098 1.382,1099 74,1100 251.046,1101 97.279,1102 271.47,1103 349.75,1104 248,1105 89,1106 231.765,1107 109.717,1108 240.573,1109 352.77,1110 226,1111 5.099}
{0 CHEMBL2049098,1 1.614,2 5.071,3 0.435,4 0.189,5 52.435,6 7.394,7 0.4,8 3.376,9 3.499,10 2.915,11 2.873,12 4.578,13 2.862,14 3.87,15 4.036,16 3.297,17 3.275,18 4.984,19 3.246,20 4.164,21 4.34,22 3.458,23 3.419,24 5.541,25 3.384,26 4.24,27 4.448,28 3.205,29 3.32,30 5.48,31 3.245,32 4.106,33 4.368,34 2.775,35 3.037,36 5.235,37 2.91,38 3.762,39 4.07,40 1.969,41 2.493,42 4.86,43 2.288,44 3.104,45 3.487,46 0.599,47 1.582,48 3.951,49 1.259,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.105,57 0.382,58 5.588,59 2.265,60 12.399,61 3.008,62 0.123,63 0.599,64 9.672,65 3.839,66 16.667,67 5.304,68 0.305,69 0.732,70 13.768,71 4.847,72 57.311,73 6.686,74 0.334,75 0.697,76 15.968,77 4.897,78 55.992,79 6.847,80 0.289,81 0.555,82 14.866,83 4.182,84 44.823,85 6.206,86 0.25,87 0.345,88 11.229,89 2.76,90 43.092,91 4.34,92 0.17,93 0.134,94 6.463,95 1.425,96 31.087,97 2.358,98 0.009,99 0.011,100 0.565,101 0.138,102 1.498,103 0.254,104 17,105 22,106 0.326,107 0.723,108 0.844,109 0.881,110 0.881,111 0.881,112 2.737,113 0.896,114 -2.25,115 -2.29,116 -2.26,117 38.5,118 1,119 1,123 1,128 3,129 2,130 1,135 1,137 6,139 1,140 2,142 1,143 7,144 1,146 4,148 2,149 3,150 3,151 6,153 1,155 4,158 1,159 4,160 1,161 2,163 1,165 2,168 5,171 3,173 2,177 1,179 1,194 128,195 9.052,196 9.052,197 9.052,198 9.052,199 9.052,200 8.167,201 10.133,202 5.086,203 9.135,204 7.32,205 7.32,206 7.32,207 7.32,208 7.32,209 5.912,210 9.093,211 2.352,212 7.424,213 3.086,214 1.116,215 0.52,216 0.337,217 0.337,218 0.337,219 3.369,221 146,222 1.732,223 56.608,224 48.792,226 0.663,227 18.96,228 0.67,229 0.83,230 0.8,231 0.5,232 0.83,233 31,234 71,235 4.484,236 4.328,237 6.793,238 4.196,239 3.216,240 4.074,241 2.291,242 11.048,243 3.15,244 3.89,245 3.326,246 6.045,247 3.589,248 2.588,249 3.158,250 1.257,251 8.297,252 2.583,253 3.336,254 3.072,255 5.423,256 3.108,257 2.138,258 2.529,259 0.08,260 6.522,261 2.07,262 2.926,263 2.07,264 4.549,265 2.566,266 1.563,267 2.078,269 4.289,270 1.563,271 2.635,272 1.935,273 3.857,274 2.318,275 1.327,276 1.646,278 3.061,279 1.313,280 1.835,281 1.467,282 3.153,283 1.432,284 0.373,285 0.482,286 0.847,287 0.389,288 1.319,289 0.788,290 2.848,291 1.122,292 0.136,293 0.153,294 0.329,295 0.134,296 0.825,297 0.058,298 2.346,299 0.486,300 -0.506,301 -0.628,302 -1.175,303 -0.501,304 0.334,305 -0.304,306 1.866,307 0.082,308 -0.891,309 -1.003,310 -2.337,311 -0.862,313 -0.605,314 1.729,315 -0.252,316 -1.293,317 -1.512,318 -3.341,319 -1.307,320 -0.071,321 -0.884,322 1.37,323 -0.35,324 -1.348,325 -1.798,326 -3.41,327 -1.38,328 -0.455,329 -1.219,330 1.258,331 -0.57,332 -1.536,333 -1.805,335 -4.669,336 -1.489,337 -0.5,338 -1.521,339 1.204,340 -0.788,341 -1.768,342 -2.147,343 -0.67,344 -5.415,345 -1.716,346 -0.611,347 -1.67,348 1.088,349 -1,350 -2,351 -2.227,352 -1.313,353 -6.48,354 -1.947,355 -0.946,356 -2,357 0.472,358 -1.039,359 -2,360 -3,361 -1.645,362 -7.566,363 -2,364 6.467,365 0.462,366 0.477,367 0.034,368 16.75,369 1.196,370 8,371 0.571,372 8.75,373 0.625,374 9.772,375 0.698,376 15.733,377 0.605,378 10.553,379 0.754,380 3.393,381 0.242,382 3.216,383 0.23,384 0.242,386 0.448,389 0.743,390 1.071,391 0.831,392 0.922,393 0.818,394 0.893,395 0.565,396 1.164,397 0.715,398 1.034,399 0.593,400 0.921,401 0.739,402 1.15,403 0.906,404 1.16,405 0.736,406 1.079,407 1.276,408 1.148,409 1.217,410 1.181,411 1.241,412 1.191,413 1.197,414 1.01,415 1.141,416 1.05,417 1.05,418 1.08,419 1.245,420 0.79,421 1.174,422 0.881,423 1.269,424 0.989,425 1.216,426 0.173,427 0.794,428 0.222,429 1.527,430 0.403,437 3,439 2.444,440 1.375,441 1.289,442 0.347,443 0.08,447 1077,448 3277,449 1.952,450 46.2,451 3,452 4,454 3,455 2,456 1.518,457 1.75,458 2.425,459 1.383,462 41.973,463 1.614,464 3.584,465 4.181,466 4.364,467 4.364,468 4.364,469 1.577,470 2.646,471 3.787,472 2.396,473 217.998,474 6.35,475 1695.46,476 122.211,477 1.557,478 3.689,479 0.2,481 0.111,482 0.057,483 0.076,484 0.035,485 0.027,489 0.506,490 0.67,491 0.788,492 50.776,493 0.014,494 0.186,495 -0.003,496 0.179,497 -0.136,498 0.097,499 0.086,500 -0.012,501 0.135,502 0.048,503 0.002,504 0.093,505 0.186,506 -0.068,507 0.003,508 -0.147,509 0.19,510 -0.116,511 -0.156,512 -0.185,513 -0.251,514 -0.229,515 -0.106,516 -0.258,517 -0.163,518 -0.151,519 -0.138,520 -0.143,521 -0.069,522 -0.135,523 -0.178,524 -0.027,525 -0.117,526 -0.042,527 -0.161,528 -0.059,529 -0.097,530 0.366,531 0.366,532 0.572,533 -0.177,534 0.565,535 0.406,536 0.458,537 1.13,538 0.826,539 0.338,540 1.089,541 2.108,542 4.35,543 0.714,544 5.878,545 1.011,546 1.134,547 1.024,548 1.05,549 0.643,550 2.773,551 3.135,552 3.434,553 3.638,554 3.85,555 3.784,556 3.638,557 3.401,558 3.296,559 2.565,560 3.229,561 0.619,562 192.24,563 2.773,564 4.317,565 5.187,566 6.08,567 6.969,568 7.864,569 8.757,570 9.653,571 10.547,572 11.443,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 15,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 4,614 3,615 4,617 2,619 2,620 2,621 1,625 1,626 1,627 1,628 1,631 14,632 1,633 1,635 1,636 1,639 7.7,640 1,642 1,645 8,646 4.733,647 3.056,648 1.432,649 1.384,650 1.241,651 0.922,652 2.114,653 7.137,654 2.996,655 3.57,656 4.107,657 4.558,658 5.041,659 5.121,660 5.198,661 5.276,662 5.269,663 4.699,664 0.5,665 24,666 5.178,667 0.002,668 2.264,669 8.107,670 9.603,671 0.001,672 7.963,673 -0.001,674 2.607,675 36.5,676 0.003,677 105.94,678 53.621,679 32.897,681 67.951,683 53.621,684 173.891,685 32.897,686 8.825,687 35.432,688 71.234,689 29.85,690 9.128,692 105.94,694 105.94,695 86.518,696 67.951,698 82.398,699 48.687,700 42.806,701 44.257,702 42.261,704 105.94,705 100.848,706 53.621,707 105.94,708 16.367,709 37.254,710 100.848,711 105.94,712 100.848,713 53.621,714 0.602,715 0.375,716 0.189,717 0.102,718 12,719 6,722 1,723 1.2,724 2.466,725 92.121,726 0.2,727 10,728 51.303,729 9.339,730 3.17,731 1.372,732 100.848,733 5.461,734 2.545,735 75.703,736 260.409,737 19,738 11.35,740 -0.442,741 26.276,742 29.491,743 0.343,744 0.763,745 0.889,746 0.928,747 0.928,748 0.928,749 4.256,750 -0.506,751 5.22,752 0.329,753 3.807,754 4.248,755 2.543,756 6.094,757 3.779,758 5.473,759 -0.891,760 6.838,761 -1.175,762 3.611,763 4.182,764 2.078,765 7.13,766 3.559,767 6.797,768 -1.293,769 8.557,770 -2.337,771 5.468,772 6.392,773 3.726,774 10.259,775 5.405,776 8.156,777 -1.348,778 10.33,779 -3.341,780 6.043,781 7.091,782 3.934,783 12.063,784 5.955,785 9.545,786 -1.536,787 12.136,788 -3.41,789 7.442,790 8.848,791 5.161,792 14.743,793 7.34,794 10.956,795 -1.768,796 13.962,797 -4.669,798 8.35,799 9.894,800 5.695,801 16.871,802 8.223,803 12.384,804 -2,805 15.805,806 -5.415,807 9.589,808 11.47,809 6.718,810 19.386,811 9.444,812 3.216,813 -2,814 17.659,815 -6.48,816 10.64,817 12.686,818 7.405,819 21.661,820 10.471,821 2.588,822 11.048,823 19.522,824 -7.566,825 11.824,826 14.178,827 8.33,828 24.109,829 11.635,830 2.138,831 8.297,832 21.393,833 4.074,834 12.937,835 15.481,836 9.089,837 26.451,838 12.724,839 1.563,840 6.522,841 23.27,842 3.158,843 14.104,844 16.931,845 9.966,846 28.872,847 13.87,848 1.327,849 4.289,850 25.152,851 2.529,852 15.245,853 18.28,854 10.76,855 31.246,856 14.987,857 0.373,858 3.061,859 27.039,860 2.078,861 16.408,862 19.708,863 11.613,864 33.655,865 16.128,866 0.136,867 0.847,868 28.929,869 1.646,870 17.562,871 21.083,872 12.425,873 36.043,874 17.259,875 1167,876 2094,877 9.364,878 16.727,879 23.117,880 25.722,881 24.437,882 22.755,883 22.683,884 28.241,885 7.256,886 68.785,887 22.406,888 5.43,889 6.328,890 6.321,891 5.235,892 5.216,893 7.074,894 3.935,895 18.614,896 5.15,897 7.799,898 1.541,899 1.715,900 1.629,901 1.517,902 1.512,903 1.883,904 0.484,905 4.586,906 1.494,907 4.009,908 4.039,909 3.958,910 3.928,911 7.429,912 3.93,913 3.579,914 3.626,915 3.496,916 3.404,917 6.465,918 3.418,919 3.224,920 3.298,921 3.083,922 3.053,923 4.987,924 3.043,925 3.004,926 3.084,927 2.816,928 2.682,929 4.684,930 2.696,931 2.87,932 2.954,933 2.737,934 2.655,935 3.887,936 2.682,937 2.578,938 2.659,939 2.35,940 2.251,941 3.74,942 2.251,943 2.43,944 2.497,945 2.203,946 1.991,947 3.273,948 2.005,949 2.185,950 2.277,951 1.901,952 1.734,953 2.825,954 1.811,955 0.299,956 0.289,957 0.453,958 0.28,959 0.214,960 4.484,961 0.272,962 4.328,963 0.153,964 6.793,965 0.737,966 4.196,967 0.21,968 3.216,969 4.074,970 2.291,971 11.048,972 3.15,973 1.973,974 1.947,975 2.079,976 2.081,977 1.297,978 2.079,979 1.527,980 1.48,981 1.726,982 1.735,983 0.886,984 1.734,985 1.221,986 1.149,987 1.538,988 1.449,989 0.602,990 1.474,991 0.869,992 0.806,993 1.171,994 1.277,995 0.19,996 1.233,997 0.836,998 0.762,999 1.096,1000 1.13,1001 0.112,1002 1.157,1003 0.517,1004 0.414,1005 0.86,1006 0.853,1008 0.839,1009 0.306,1010 0.194,1011 0.701,1012 0.749,1014 0.738,1015 0.083,1016 0.011,1017 0.55,1018 0.488,1020 0.523,1021 3.434,1022 4.779,1023 6.347,1024 8.019,1025 9.743,1026 1.94,1029 5.601,1030 9.529,1031 0.498,1033 -0.631,1034 0.649,1036 16.106,1037 41.973,1038 93.192,1039 108.702,1040 113.457,1041 113.457,1042 113.457,1043 25.571,1044 5.753,1045 66.56,1046 66.56,1047 12,1048 11.968,1049 3,1050 2.322,1051 21.084,1052 29,1053 18,1054 0.425,1055 101.779,1056 174.96,1057 240.1,1058 1663,1060 10.293,1061 0.735,1062 0.564,1063 10.293,1064 7.897,1065 6.609,1066 0.441,1067 0.299,1068 4.419,1069 6.351,1070 4.288,1071 3.562,1072 6.609,1073 4.479,1074 6.167,1075 0.28,1076 0.161,1077 6.167,1078 3.533,1079 5.524,1080 0.184,1081 0.085,1082 5.524,1083 2.564,1084 4.138,1085 0.112,1086 0.047,1087 4.138,1088 1.734,1089 3.292,1090 0.072,1091 0.026,1092 3.292,1093 1.187,1094 0.598,1095 41.72,1096 0.327,1097 13.497,1098 1.382,1099 74,1100 224.843,1101 81.76,1102 218.087,1103 290.83,1104 200,1105 89,1106 214.902,1107 98.007,1108 215.453,1109 314.31,1110 202,1111 5}
{0 CHEMBL2049099,1 1.681,2 5.467,3 -0.067,4 0.005,5 53.857,6 7.713,7 0.375,8 3.431,9 3.541,10 3.001,11 2.868,12 4.671,13 2.886,14 3.923,15 4.073,16 3.36,17 3.248,18 5.078,19 3.254,20 4.172,21 4.331,22 3.542,23 3.386,24 5.582,25 3.393,26 4.246,27 4.42,28 3.353,29 3.311,30 5.55,31 3.293,32 4.138,33 4.347,34 3.025,35 3.119,36 5.386,37 3.036,38 3.941,39 4.236,40 2.424,41 2.716,42 5.046,43 2.554,44 3.397,45 3.724,46 1.369,47 2.065,48 4.419,49 1.826,50 2.675,51 3.064,52 0.346,53 1.136,54 3.497,55 0.845,56 0.139,57 0.387,58 5.585,59 2.292,60 13.472,61 2.898,62 0.251,63 0.589,64 10.164,65 3.714,66 22.942,67 4.886,68 0.398,69 0.706,70 13.45,71 4.578,72 61.451,73 6.101,74 0.522,75 0.667,76 15.703,77 4.575,78 60.616,79 6.03,80 0.499,81 0.563,82 14.761,83 4.317,84 54.668,85 6.066,86 0.437,87 0.41,88 13.663,89 3.217,90 44.502,91 5.226,92 0.242,93 0.211,94 8.293,95 1.792,96 35.424,97 2.997,98 0.145,99 0.07,100 4.581,101 0.859,102 23.525,103 1.522,104 18,105 23,106 0.336,107 0.751,108 0.851,109 0.886,110 0.886,111 0.886,112 2.798,113 0.861,114 -1.73,115 -1.8,116 -1.82,117 37,119 1,121 1,123 1,128 3,129 1,130 2,135 1,137 3,139 1,140 4,142 1,143 3,144 1,146 5,148 2,149 3,150 3,151 3,153 1,154 1,155 4,158 1,159 2,160 1,161 1,165 1,166 1,167 2,168 3,171 2,172 1,173 1,177 1,179 1,194 176,195 9.922,196 9.922,197 9.922,198 9.922,199 9.922,200 9.089,201 12.104,202 5.607,203 10.177,204 7.757,205 7.757,206 7.757,207 7.757,208 7.757,209 6.339,210 12.066,211 2.504,212 8.041,213 3.074,214 1.001,215 0.5,216 0.324,217 0.324,218 0.324,219 3.436,221 167,222 2,223 62.392,224 53.803,226 0.836,227 22.413,228 1,229 1,230 1,231 0.5,232 0.93,233 34,234 82,235 4.494,236 4.328,237 6.808,238 4.199,239 3.224,240 4.087,241 2.291,242 11.139,243 3.137,244 3.91,245 3.326,246 6.094,247 3.602,248 2.624,249 3.173,250 1.257,251 8.522,252 2.562,253 3.367,254 3.164,255 5.471,256 3.119,257 2.16,258 2.565,259 0.86,260 6.666,261 2.065,262 2.934,263 2.273,264 4.692,265 2.6,266 1.63,267 2.081,268 0.08,269 4.624,270 1.573,271 2.669,272 1.989,273 3.863,274 2.337,275 1.355,276 1.686,278 3.073,279 1.325,280 1.848,281 1.468,282 3.18,283 1.476,284 0.564,285 0.631,286 1.014,287 0.499,288 1.693,289 1.184,290 3.032,291 1.399,292 0.364,293 0.469,294 0.812,295 0.377,296 1.069,297 0.552,298 2.527,299 0.844,300 -0.101,301 -0.112,302 -0.204,303 -0.095,304 0.676,305 -0.007,306 2.235,307 0.273,308 -0.688,309 -0.877,310 -1.494,311 -0.653,312 0.322,313 -0.4,314 1.754,315 0.042,316 -0.923,317 -1.036,318 -2.41,319 -0.883,321 -0.651,322 1.696,323 -0.253,324 -1.298,325 -1.546,326 -3.35,327 -1.333,328 -0.395,329 -0.887,330 1.362,331 -0.541,332 -1.495,333 -1.798,335 -4.142,336 -1.414,337 -0.483,338 -1.263,339 1.21,340 -0.676,341 -1.602,342 -1.92,343 -0.67,344 -4.674,345 -1.495,346 -0.5,347 -1.527,348 1.094,349 -0.881,350 -1.813,351 -2.148,352 -0.86,353 -5.434,354 -1.718,355 -0.657,356 -1.671,357 0.571,358 -1,359 -2,360 -2.254,361 -1.313,362 -6.561,363 -1.947,364 6.8,365 0.453,366 0.439,367 0.029,368 18.25,369 1.217,370 8.5,371 0.567,372 9.75,373 0.65,374 10.044,375 0.67,376 17.2,377 0.637,378 12.26,379 0.817,380 3.836,381 0.256,382 3.311,383 0.221,384 0.23,386 0.426,389 0.814,390 1.186,391 0.789,392 1.035,393 0.828,394 0.918,395 0.886,396 1.127,397 0.77,398 0.969,399 0.684,400 0.857,401 0.84,402 1.166,403 0.845,404 1.145,405 0.787,406 1.014,407 1.366,408 1.075,409 1.233,410 1.116,411 1.358,412 1.14,413 1.052,414 1.145,415 1.197,416 1.214,417 1.054,418 1.254,419 0.846,420 0.821,421 1.016,422 0.865,423 0.751,424 0.96,425 1.031,426 0.601,427 1.137,428 0.737,429 1.327,430 0.918,431 1.036,433 0.62,434 0.007,435 1.665,436 0.187,437 3,439 2.444,440 1.375,441 1.329,442 0.549,443 0.161,447 1302,448 4442,449 1.955,450 44.4,452 7,454 3,455 2,456 1.54,457 1.765,458 2.517,459 1.378,462 45.388,463 1.681,464 3.754,465 4.255,466 4.431,467 4.431,468 4.431,469 1.889,470 3.774,471 3.883,472 2.521,473 264.688,474 6.549,475 2148.01,476 128.382,477 1.566,478 3.796,479 0.188,481 0.106,482 0.053,483 0.066,484 0.042,485 0.027,489 0.482,490 0.67,491 1.029,492 56.42,493 -0.033,494 0.084,495 0.007,496 0.086,497 -0.138,498 0.063,499 -0.057,500 0.015,501 0.09,502 0.106,503 -0.043,504 0.132,505 0.087,506 -0.067,507 0.05,508 -0.123,509 0.175,510 -0.057,511 -0.205,512 -0.084,513 -0.272,514 -0.16,515 -0.173,516 -0.226,517 -0.013,518 -0.243,519 -0.219,520 -0.261,521 -0.056,522 -0.298,523 0.055,524 -0.041,525 0.038,526 -0.01,527 0.082,528 0.013,529 -0.133,530 0.109,531 -0.043,532 0.073,533 -0.196,534 0.054,535 -0.011,536 0.435,537 0.626,538 0.75,539 -0.149,540 0.841,541 2.157,542 4.398,543 0.667,544 6.916,545 1.022,546 1.137,547 0.505,548 0.255,549 0.636,550 2.833,551 3.178,552 3.497,553 3.714,554 3.932,555 3.912,556 3.807,557 3.611,558 3.434,559 2.89,560 3.453,561 0.623,562 208.24,563 2.833,564 4.369,565 5.242,566 6.133,567 7.026,568 7.923,569 8.819,570 9.717,571 10.614,572 11.512,573 7.4,574 1,578 1,579 3,580 3,582 1,584 1,586 27,587 7,588 16,589 28,590 10,591 3,592 3,594 2,595 3,598 2,601 2,602 7,603 3,605 1,606 1,608 1,610 1,612 12,613 5,614 3,615 5,617 2,619 3,620 2,621 1,625 1,626 1,627 1,628 1,631 15,632 1,633 1,634 1,635 1,636 1,639 11.1,640 1,642 1,644 1,645 8.5,646 4.9,647 3.389,648 1.39,649 1.389,650 1.236,651 0.907,652 2.542,653 7.278,654 3.045,655 3.597,656 4.155,657 4.619,658 5.107,659 5.221,660 5.359,661 5.397,662 5.39,663 4.931,664 0.75,665 26,666 5.536,667 -0.001,668 2.4,669 8.167,670 10.137,672 8.208,674 2.667,675 40,676 0.002,677 105.94,678 57.737,679 32.897,681 78.95,683 57.737,684 184.89,685 32.897,686 10.883,687 35.432,688 71.234,689 29.85,690 22.186,692 105.94,694 105.94,695 90.634,696 78.95,698 82.398,699 59.687,700 42.806,701 35.432,702 55.202,704 105.94,705 111.848,706 57.737,707 105.94,708 18.425,709 39.312,710 111.848,711 105.94,712 111.848,713 57.737,714 0.589,715 0.378,716 0.197,717 0.106,718 12,719 6,720 0.036,721 1,722 1,723 1.2,724 2.563,725 101.197,726 0.2,727 10,728 58.603,729 10.265,730 3.715,731 1.555,732 111.848,733 5.141,734 1.838,735 75.703,736 275.524,737 20,738 11.398,740 -0.49,741 27.604,742 30.701,743 0.354,744 0.79,745 0.895,746 0.932,747 0.932,748 0.932,749 4.297,750 -0.101,751 5.263,752 0.812,753 3.85,754 4.277,755 2.653,756 6.138,757 3.79,758 5.502,759 -0.688,760 6.878,761 -0.204,762 3.611,763 4.182,764 2.078,765 7.186,766 3.525,767 6.823,768 -0.923,769 8.596,770 -1.494,771 5.509,772 6.416,773 3.752,774 10.314,775 5.396,776 8.18,777 -1.298,778 10.369,779 -2.41,780 6.066,781 7.11,782 3.934,783 12.134,784 5.923,785 9.57,786 -1.495,787 12.175,788 -3.35,789 7.482,790 8.872,791 5.166,792 14.81,793 7.317,794 10.982,795 -1.602,796 14.003,797 -4.142,798 8.382,799 9.921,800 5.695,801 16.951,802 8.187,803 12.412,804 -1.813,805 15.847,806 -4.674,807 9.627,808 11.497,809 6.719,810 19.466,811 9.41,812 3.224,813 -2,814 17.703,815 -5.434,816 10.677,817 12.718,818 7.405,819 21.75,820 10.43,821 2.624,822 11.139,823 19.567,824 -6.561,825 11.863,826 14.21,827 8.33,828 24.201,829 11.592,830 2.16,831 8.522,832 21.439,833 4.087,834 12.977,835 15.517,836 9.089,837 26.552,838 12.676,839 1.63,840 6.666,841 23.318,842 3.173,843 14.145,844 16.968,845 9.966,846 28.978,847 13.819,848 1.355,849 4.624,850 25.201,851 2.565,852 15.287,853 18.322,854 10.76,855 31.359,856 14.933,857 0.564,858 3.073,859 27.089,860 2.081,861 16.451,862 19.752,863 11.613,864 33.775,865 16.071,866 0.364,867 1.014,868 28.98,869 1.686,870 17.606,871 21.13,872 12.425,873 36.171,874 17.198,875 1408,876 2656,877 10.057,878 17.182,879 24.33,880 26.821,881 26.028,882 23.901,883 23.841,884 29.383,885 8.976,886 71.701,887 23.076,888 5.44,889 6.328,890 6.396,891 5.238,892 5.224,893 7.087,894 3.935,895 18.719,896 5.137,897 8.372,898 1.521,899 1.676,900 1.627,901 1.494,902 1.49,903 1.836,904 0.561,905 4.481,906 1.442,907 4.001,908 4.026,909 3.956,910 3.903,911 7.429,912 3.911,913 3.571,914 3.613,915 3.495,916 3.391,917 6.465,918 3.406,919 3.265,920 3.327,921 3.115,922 2.993,923 4.991,924 3.011,925 3.078,926 3.144,927 2.918,928 2.77,929 4.819,930 2.787,931 2.881,932 2.973,933 2.742,934 2.676,935 4.358,936 2.684,937 2.668,938 2.724,939 2.496,940 2.422,941 3.748,942 2.44,943 2.502,944 2.575,945 2.29,946 2.055,947 3.477,948 2.068,949 2.278,950 2.349,951 2.017,952 1.754,953 3.036,954 1.847,955 0.281,956 0.271,957 0.426,958 0.262,959 0.202,960 4.494,961 0.255,962 4.328,963 0.143,964 6.808,965 0.696,966 4.199,967 0.196,968 3.224,969 4.087,970 2.291,971 11.139,972 3.137,973 1.948,974 1.926,975 2.043,976 2.073,977 1.265,978 2.062,979 1.512,980 1.467,981 1.703,982 1.726,983 0.838,984 1.718,985 1.203,986 1.134,987 1.569,988 1.513,989 0.574,990 1.53,991 0.952,992 0.895,993 1.188,994 1.326,995 0.233,996 1.267,997 0.838,998 0.762,999 1.122,1000 1.144,1001 0.132,1002 1.169,1003 0.613,1004 0.551,1005 0.895,1006 0.877,1008 0.89,1009 0.382,1010 0.257,1011 0.746,1012 0.82,1014 0.778,1015 0.107,1016 0.043,1017 0.577,1018 0.584,1020 0.595,1021 3.497,1022 4.828,1023 6.392,1024 8.062,1025 9.787,1026 1.541,1029 5.6,1030 9.568,1031 0.384,1032 5.14,1033 -0.709,1034 0.589,1036 16.821,1037 45.388,1038 101.362,1039 114.872,1040 119.627,1041 119.627,1042 119.627,1043 28.901,1044 5.889,1045 75.79,1046 75.79,1047 12,1048 12.035,1049 3,1050 2.322,1051 23.316,1052 32,1053 29,1054 0.408,1055 105.775,1056 183.75,1057 249.85,1058 1987,1060 11,1061 0.733,1062 0.554,1063 11,1064 8.305,1065 7.147,1066 0.447,1067 0.287,1068 4.49,1069 6.736,1070 4.385,1071 3.636,1072 7.147,1073 4.592,1074 6.358,1075 0.276,1076 0.149,1077 6.358,1078 3.419,1079 5.838,1080 0.182,1081 0.078,1082 5.838,1083 2.506,1084 4.472,1085 0.112,1086 0.043,1087 4.472,1088 1.732,1089 3.531,1090 0.071,1091 0.023,1092 3.531,1093 1.171,1094 0.581,1095 46.063,1096 0.315,1097 14.501,1098 1.31,1099 78,1100 272.578,1101 88.638,1102 255.654,1103 338.73,1104 236,1105 94,1106 245.448,1107 105.997,1108 244.525,1109 356.79,1110 228,1111 5.308}
{0 CHEMBL2049100,1 1.989,2 5.647,3 0.891,4 0.794,5 53.368,6 9.47,7 0.333,8 3.427,9 3.53,10 3.133,11 2.862,12 4.788,13 2.925,14 3.974,15 4.101,16 3.664,17 3.263,18 5.906,19 3.329,20 4.211,21 4.367,22 3.707,23 3.407,24 5.791,25 3.459,26 4.324,27 4.497,28 3.651,29 3.297,30 5.895,31 3.381,32 4.247,33 4.454,34 3.447,35 3.003,36 5.865,37 3.111,38 3.937,39 4.168,40 3.163,41 2.448,42 6.012,43 2.588,44 3.356,45 3.627,46 2.191,47 1.519,48 5.568,49 1.658,50 1.02,51 1.365,52 0.014,53 0.255,54 1.099,55 0.13,56 0.299,57 0.612,58 3.321,59 2.361,60 60.194,61 2.169,62 0.877,63 1.223,64 7.535,65 4.029,66 164.818,67 3.984,68 0.788,69 1.025,70 10.488,71 4.973,72 143.255,73 5.446,74 1.111,75 1.102,76 14.074,77 5.085,78 200.674,79 4.907,80 1.285,81 0.935,82 16.112,83 4.365,84 223.258,85 4.052,86 1.154,87 0.562,88 13.764,89 2.863,90 212.463,91 3.171,92 0.901,93 0.179,94 10.249,95 1.531,96 176.971,97 1.353,98 0.033,99 0.002,100 0.992,101 0.131,102 5.407,103 0.32,104 38,105 28,106 0.401,107 0.77,108 0.844,109 0.881,110 0.881,111 0.881,112 2.911,113 0.799,114 -2.96,115 -2.96,116 -2.86,117 38.5,119 1,123 1,125 1,128 3,129 2,130 1,135 1,137 5,139 1,140 2,142 1,143 5,144 1,146 4,148 2,149 3,150 3,151 4,153 1,155 3,158 1,159 4,160 1,161 1,163 1,165 2,168 3,171 2,173 1,177 1,179 1,194 266,195 10.524,196 10.524,197 10.524,198 10.524,199 10.524,200 9.73,201 12.163,202 5.78,203 10.858,204 8.814,205 8.814,206 8.814,207 8.814,208 8.814,209 7.459,210 11.609,211 2.684,212 9.401,213 2.712,214 0.885,215 0.52,216 0.337,217 0.337,218 0.337,219 3.546,221 193,222 3,223 73.959,224 63.825,226 0.886,227 46.452,228 0.83,229 1,230 0.8,231 0.5,232 0.88,233 41.5,234 96,235 4.635,236 4.477,237 7.302,238 4.348,239 3.432,240 4.18,241 3.825,242 12.542,243 3.213,244 4.192,245 4.32,246 6.65,247 3.978,248 3.057,249 3.371,250 2.291,251 10.402,252 2.786,253 3.675,254 3.326,255 5.867,256 3.352,257 2.384,258 2.894,259 1.257,260 7.754,261 2.258,262 3.134,263 2.91,264 5.299,265 2.971,266 2.025,267 2.209,268 0.08,269 6.226,270 1.889,271 2.892,272 2.014,273 4.43,274 2.438,275 1.446,276 2.051,278 3.824,279 1.425,280 2.508,281 1.71,282 3.858,283 2.16,284 1.196,285 1.494,286 3.035,287 1.133,288 1.831,289 1.466,290 3.174,291 1.427,292 0.369,293 0.478,294 0.84,295 0.385,296 1.175,297 0.661,298 3.029,299 0.962,300 -0.008,301 -0.009,302 -0.022,303 -0.008,304 0.728,305 0.51,306 2.547,307 0.319,308 -0.664,309 -0.865,310 -1.659,311 -0.65,312 0.324,313 0.51,314 2.242,315 0.05,316 -0.921,317 -1,318 -2.476,319 -0.7,321 -0.002,322 2,323 -0.253,324 -1,325 -1,326 -3,327 -0.7,329 -0.418,330 2,331 -0.3,332 -1,333 -1.037,335 -3,336 -0.89,338 -0.682,339 1.752,340 -0.3,341 -1.298,342 -1.554,343 -0.67,344 -3.35,345 -1.343,346 -0.421,347 -0.889,348 1.691,349 -0.541,350 -1.505,351 -1.798,352 -0.805,353 -4.662,354 -1.467,355 -0.5,356 -1.326,357 1.361,358 -0.678,359 -1.645,360 -1.981,361 -1.313,362 -5.326,363 -1.584,364 7.324,365 0.431,366 0.766,367 0.045,368 19,369 1.118,370 8,371 0.471,372 11,373 0.647,374 12.638,375 0.743,376 20.276,377 0.78,378 15.65,379 0.921,380 4.031,381 0.237,382 3.789,383 0.223,384 0.263,385 0.068,386 0.396,387 3,389 0.643,390 0.898,391 0.613,392 0.927,393 0.713,394 0.817,395 0.427,396 0.742,397 0.552,398 1.014,399 0.436,400 0.942,401 0.6,402 0.876,403 0.687,404 1.149,405 0.577,406 1.059,407 1.118,408 1.121,409 1.085,410 1.186,411 1.081,412 1.146,413 1.454,414 1.172,415 1.358,416 1.058,417 1.494,418 1.105,419 1.198,420 1.092,421 1.167,422 0.893,423 1.211,424 0.962,425 1.885,426 1.101,427 1.834,428 0.23,429 1.824,430 0.628,437 5,439 3.111,440 2,441 1.587,442 0.951,443 0.322,447 1764,448 9124,449 1.882,450 34.6,452 4,454 3,455 2,456 1.58,457 1.659,458 2.546,459 1.366,461 1,462 51.708,463 1.989,464 3.815,465 4.181,466 4.364,467 4.364,468 4.364,469 1.954,470 3.264,471 4.065,472 2.62,473 356.327,474 6.92,475 3155.5,476 122.211,477 1.792,478 3.933,479 0.278,481 0.111,482 0.067,483 0.061,484 0.05,485 0.027,489 0.594,490 0.67,491 1.011,492 67.432,493 -0.059,494 0.022,495 -0.037,496 0.167,497 -0.132,498 0.121,499 0.358,500 0.317,501 0.169,502 0.073,503 0.344,504 0.006,505 0.042,506 -0.121,507 0.091,508 -0.154,509 0.071,510 -0.058,511 -0.237,512 -0.273,513 -0.167,514 -0.243,515 -0.187,516 -0.189,517 -0.305,518 -0.126,519 -0.268,520 -0.142,521 -0.368,522 -0.17,523 0.11,524 -0.019,525 0.095,526 -0.04,527 0.087,528 -0.017,529 -0.111,530 0.241,531 -0.263,532 0.601,533 -0.002,534 0.315,535 0.54,536 0.04,537 1.68,538 0.744,539 0.46,540 1.604,541 5.785,542 4.701,543 0.588,544 8.055,545 1.07,546 1.173,547 1.726,548 2.978,549 0.636,550 2.944,551 3.367,552 3.611,553 3.85,554 4.078,555 4.127,556 4.078,557 3.932,558 3.664,559 3.332,560 3.708,561 0.664,562 246.21,563 2.944,564 4.533,565 5.398,566 6.323,567 7.213,568 8.137,569 9.035,570 9.957,571 10.858,572 11.78,573 7.7,574 1,578 1,579 3,580 3,582 1,586 26,587 7,588 18,589 27,590 10,591 3,592 3,594 2,595 3,597 1,598 2,600 1,601 2,602 7,603 3,605 1,606 1,608 1,610 1,611 3,612 9,613 7,614 3,615 7,617 2,619 2,620 2,621 1,625 1,626 1,627 1,630 3,631 17,632 1,633 1,635 1,636 1,637 1,638 3,639 7.7,640 1,642 1,645 10.25,646 4.412,647 3.556,648 1.351,649 1.392,650 1.227,651 0.925,652 2.7,653 7.514,654 3.135,655 3.726,656 4.245,657 4.731,658 5.227,659 5.395,660 5.619,661 5.603,662 5.596,663 5.278,664 0.75,665 30,666 6.823,668 3.593,669 9.015,670 10.851,672 9.057,674 3.515,675 59.75,677 70.627,678 52.555,679 32.897,681 67.951,682 44.88,683 52.555,684 138.577,685 77.778,687 35.432,688 71.234,689 29.85,690 54.008,692 70.627,693 7.76,694 70.627,695 85.453,696 112.831,698 47.084,699 93.567,700 42.806,701 43.191,702 42.261,704 115.507,705 100.848,706 52.555,707 78.386,708 16.367,709 28.429,710 145.728,711 70.627,712 145.728,713 52.555,714 0.618,715 0.359,716 0.179,717 0.098,718 15,719 8,722 1,723 1.2,724 2.648,725 123.602,726 0.2,727 10,728 64.732,729 12.052,730 3.808,731 1.931,732 145.728,733 3.276,734 -1.196,735 75.703,736 268.91,737 22,738 11.318,740 -0.808,741 27.814,742 30.511,743 0.423,744 0.812,745 0.889,746 0.928,747 0.928,748 0.928,749 4.449,750 -0.008,751 5.501,752 0.84,753 4.043,754 4.407,755 3.483,756 6.444,757 3.93,758 5.708,759 -0.664,760 7.169,761 -0.022,762 4.111,763 4.494,764 4.035,765 7.799,766 3.829,767 7.068,768 -0.921,769 8.948,770 -1.659,771 5.844,772 6.575,773 5.585,774 10.848,775 5.594,776 8.462,777 -1,778 10.785,779 -2.476,780 6.621,781 7.377,782 6.75,783 12.91,784 6.216,785 9.885,786 -1,787 12.658,788 -3,789 7.981,790 9.068,791 8.111,792 15.593,793 7.572,794 11.328,795 -1.298,796 14.553,797 -3,798 9.024,799 10.183,800 9.413,801 17.92,802 8.497,803 12.787,804 -1.505,805 16.465,806 -3.35,807 10.274,808 11.727,809 10.752,810 20.488,811 9.712,812 3.432,813 -1.645,814 18.389,815 -4.662,816 11.419,817 12.993,818 12.084,819 22.923,820 10.764,821 3.057,822 12.542,823 20.322,824 -5.326,825 12.637,826 14.473,827 13.423,828 25.455,829 11.932,830 2.384,831 10.402,832 22.263,833 4.18,834 13.822,835 15.815,836 14.761,837 27.937,838 13.04,839 2.025,840 7.754,841 24.21,842 3.371,843 15.034,844 17.267,845 16.102,846 30.458,847 14.194,848 1.446,849 6.226,850 26.162,851 2.894,852 16.237,853 18.649,854 17.442,855 32.961,856 15.327,857 1.196,858 3.824,859 28.118,860 2.209,861 17.45,862 20.088,863 18.784,864 35.48,865 16.479,866 0.369,867 3.035,868 30.078,869 2.051,870 18.662,871 21.492,872 20.125,873 37.994,874 17.625,875 1914,876 4410,877 10.751,878 16.54,879 28.622,880 30.05,881 29.604,882 28.16,883 27.818,884 33.356,885 14.906,886 89.247,887 26.182,888 5.582,889 6.477,890 6.807,891 5.387,892 5.432,893 7.18,894 5.47,895 20.445,896 5.213,897 11.122,898 1.59,899 1.669,900 1.645,901 1.564,902 1.545,903 1.853,904 0.828,905 4.958,906 1.455,907 4.019,908 4.046,909 3.983,910 3.927,911 8.513,912 3.934,913 3.597,914 3.64,915 3.555,916 3.403,917 7.999,918 3.423,919 3.322,920 3.372,921 3.298,922 3.045,923 7.999,924 3.092,925 3.056,926 3.114,927 2.963,928 2.681,929 7.429,930 2.728,931 2.875,932 2.962,933 2.742,934 2.651,935 6.465,936 2.683,937 2.599,938 2.669,939 2.446,940 2.245,941 4.986,942 2.289,943 2.455,944 2.514,945 2.272,946 1.988,947 4.636,948 2.02,949 2.213,950 2.292,951 1.972,952 1.733,953 3.751,954 1.819,955 0.257,956 0.249,957 0.406,958 0.242,959 0.191,960 4.635,961 0.232,962 4.477,963 0.213,964 7.302,965 0.697,966 4.348,967 0.179,968 3.432,969 4.18,970 3.825,971 12.542,972 3.213,973 1.966,974 1.943,975 2.053,976 2.083,977 1.285,978 2.071,979 1.52,980 1.475,981 1.703,982 1.738,983 0.854,984 1.722,985 1.137,986 1.1,987 1.246,988 1.463,989 0.316,990 1.381,991 0.842,992 0.777,993 1.147,994 1.284,995 0.148,996 1.208,997 0.817,998 0.762,999 0.997,1000 1.132,1002 1.141,1003 0.489,1004 0.387,1005 0.814,1006 0.853,1008 0.83,1009 0.267,1010 0.176,1011 0.633,1012 0.752,1014 0.724,1015 0.07,1016 0.001,1017 0.46,1018 0.492,1020 0.501,1021 3.611,1022 5.004,1023 6.597,1024 8.283,1025 10.018,1028 38.104,1029 5.377,1030 9.427,1031 -0.235,1033 -1.156,1034 0.179,1035 -4.535,1036 17.256,1037 51.708,1038 99.192,1039 108.702,1040 113.457,1041 113.457,1042 113.457,1043 52.535,1044 6.122,1045 66.56,1046 66.56,1047 12,1048 12.291,1049 3,1050 2.322,1051 28.073,1052 38,1053 30,1054 0.4,1055 105.373,1056 193.17,1057 248.87,1058 2641,1059 11.5,1060 12.793,1061 0.753,1062 0.502,1063 10.293,1064 8.53,1065 7.82,1066 0.434,1067 0.266,1068 4.66,1069 7.266,1070 4.65,1071 3.77,1072 6.609,1073 4.796,1074 8.162,1075 0.292,1076 0.134,1077 6.167,1078 3.762,1079 6.278,1080 0.174,1081 0.073,1082 5.524,1083 2.635,1084 4.919,1085 0.107,1086 0.04,1087 4.138,1088 1.836,1089 3.871,1090 0.067,1091 0.021,1092 3.292,1093 1.246,1094 0.572,1095 51.238,1096 0.305,1097 16.249,1098 1.278,1099 92,1100 501.176,1101 116.777,1102 397.814,1103 498.37,1104 362,1105 110,1106 338.902,1107 129.483,1108 318.687,1109 487.65,1110 298,1111 5}