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
MM130403;MM130403;DOPC;MDCG;-1;27;"MARTINI bead: C5_P1";;;;;;;0.81;;-3.76;;;"Menichetti R, Kanekal KH, Bereau T.: Drug-Membrane Permeability across Chemical Space. ACS Cent Sci, Volume 5 (2), 290-298, 2019"
MM130403;MM130403;1-octanol;ALOGPS;-1;25;"MARTINI bead: C5_P1";;;;;;;0.74;;;;;"Menichetti R, Kanekal KH, Bereau T.: Drug-Membrane Permeability across Chemical Space. ACS Cent Sci, Volume 5 (2), 290-298, 2019"
MM130403;MM130403;1-octanol;XLOGP3;;;;;;;;;;1.1;;;;;"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"
MM130403;MM130403;DMPC;CCM18;0;25;;;;;;;;0.48;;-2.28;;;"in-house calculations"
MM130403;MM130403;DMPC;CCM18;-1;25;;;;;;;;0.37;;-26.96;;;"in-house calculations"