substance;substance_identifier;membrane;method;charge;temperature;note;x_min;x_min_acc;g_pen;g_pen_acc;g_wat;g_wat_acc;log_k;log_k_acc;log_perm;log_perm_acc;primary_publication;secondary_publication
L-dopa;MM00746;DMPC;CCM15;0;25;;1.879;;6.796;;2.03;;1.06;;;;;"in-house calculations"
L-dopa;MM00746;DOPC;CCM15;0;25;;1.796;;6.164;;1.848;;0.882;;;;;"in-house calculations"
L-dopa;MM00746;"SC mix";CCM15;0;25;;2.487;;7.922;;1.222;;0.159;;;;;"in-house calculations"
L-dopa;MM00746;DOPC;CCM18;0;25;;;;;;;;;;-4.52884;;;"in-house calculations"
L-dopa;MM00746;Caco2/MDCK;CPapp;0;37;;;;;;;;;;-5.70774;;;"Bittermann K, Goss KU.: Predicting apparent passive permeability of Caco-2 and MDCK cell-monolayers: A mechanistic model. PLoS One, Volume 12 (12), e0190319, 2017"
L-dopa;MM00746;BBB;EPAMOL;;25;;;;;;;;;;-7.81;;;"Tsinman O, Tsinman K, Sun N, Avdeef A.: Physicochemical selectivity of the BBB microenvironment governing passive diffusion--matching with a porcine brain lipid extract artificial membrane permeability model. Pharm Res, Volume 28 (2), 337-363, 2011"
L-dopa;MM00746;CACO;QSAR-PSA;;25;;;;;;;;;;-5.143;;;"Subramanian G, Kitchen DB.: Computational approaches for modeling human intestinal absorption and permeability. J Mol Model, Volume 12 (5), 577-589, 2006"
L-dopa;MM00746;CACO;QSAR-HB;;25;;;;;;;;;;-5.474;;;"Subramanian G, Kitchen DB.: Computational approaches for modeling human intestinal absorption and permeability. J Mol Model, Volume 12 (5), 577-589, 2006"
L-dopa;MM00746;1-octanol;XLOGP3;;;;;;;;;;-2.7;;;;;"Kim S, Chen J, Cheng T, Gindulyte A, He J, He S, Li Q, Shoemaker BA, Thiessen PA, Yu B, Zaslavsky L, Zhang J, Bolton EE.: PubChem 2023 update. Nucleic Acids Res, Volume 51 (d1), D1373-D1380, 2023"
L-dopa;MM00746;LEC;CPMM;0;25;"<a href=https://permm.phar.umich.edu/  target=_blank>PerMM web server</a>";;;;;;;;;-6.54;;;"Lomize AL,Hage JM, Schnitzer K, Golobokov K, LaFaive MB, Forsyth AC, Pogozheva ID: PerMM: A Web Tool and Database for Analysis of Passive Membrane Permeability and Translocation Pathways of Bioactive Molecules. J. Chem. Inf. Model. 59(7), 3094-3099, 2019"
L-dopa;MM00746;LEC;CPMM;+1-1;25;"pH=7.4 ,<a href=https://permm.phar.umich.edu/  target=_blank>PerMM web server</a>";;;;;;;;;-14.55;;;"Lomize AL,Hage JM, Schnitzer K, Golobokov K, LaFaive MB, Forsyth AC, Pogozheva ID: PerMM: A Web Tool and Database for Analysis of Passive Membrane Permeability and Translocation Pathways of Bioactive Molecules. J. Chem. Inf. Model. 59(7), 3094-3099, 2019"
L-dopa;MM00746;CACO;ECACO;0;25;"<a href=https://pubchem.ncbi.nlm.nih.gov/bioassay/592681  target=_blank>592681</a>";;;;;;;;;-5.82;;;"Kim S, Chen J, Cheng T, Gindulyte A, He J, He S, Li Q, Shoemaker BA, Thiessen PA, Yu B, Zaslavsky L, Zhang J, Bolton EE.: PubChem 2023 update. Nucleic Acids Res, Volume 51 (d1), D1373-D1380, 2023"
L-dopa;MM00746;CACO;ECACO;;37;"pH 7,2";;;;;;;;;-6;;;"Garberg P, Ball M, Borg N, Cecchelli R, Fenart L, Hurst RD, Lindmark T, Mabondzo A, Nilsson JE, Raub TJ, Stanimirovic D, Terasaki T, Oberg JO, Osterberg T. In vitro models for the blood-brain barrier. Toxicol In Vitro. 2005 Apr;19(3):299-334."
L-dopa;MM00746;MDCK;EMDCK;;37;"pH 7,2";;;;;;;;;-6.15;;;"Garberg P, Ball M, Borg N, Cecchelli R, Fenart L, Hurst RD, Lindmark T, Mabondzo A, Nilsson JE, Raub TJ, Stanimirovic D, Terasaki T, Oberg JO, Osterberg T. In vitro models for the blood-brain barrier. Toxicol In Vitro. 2005 Apr;19(3):299-334."