pc.data: Partition Coefficient Data

In httk: High-Throughput Toxicokinetics

Partition Coefficient Data

Description

Measured rat in vivo partition coefficients and data for predicting them.

Usage

pc.data

Format

A data.frame.

Author(s)

Jimena Davis and Robert Pearce

References

Schmitt, W., General approach for the calculation of tissue to plasma partition coefficients. Toxicology in Vitro, 2008. 22(2): p. 457-467.

Schmitt, W., Corrigendum to:"General approach for the calculation of tissue to plasma partition coefficients"[Toxicology in Vitro 22 (2008) 457-467]. Toxicology in Vitro, 2008. 22(6): p. 1666.

Poulin, P. and F.P. Theil, A priori prediction of tissue: plasma partition coefficients of drugs to facilitate the use of physiologically based pharmacokinetic models in drug discovery. Journal of pharmaceutical sciences, 2000. 89(1): p. 16-35.

Rodgers, T. and M. Rowland, Physiologically based pharmacokinetic modelling 2: predicting the tissue distribution of acids, very weak bases, neutrals and zwitterions. Journal of pharmaceutical sciences, 2006. 95(6): p. 1238-1257.

Rodgers, T., D. Leahy, and M. Rowland, Physiologically based pharmacokinetic modeling 1: predicting the tissue distribution of moderate-to-strong bases. Journal of pharmaceutical sciences, 2005. 94(6): p. 1259-1276.

Rodgers, T., D. Leahy, and M. Rowland, Tissue distribution of basic drugs: Accounting for enantiomeric, compound and regional differences amongst beta-blocking drugs in rat. Journal of pharmaceutical sciences, 2005. 94(6): p. 1237-1248.

Gueorguieva, I., et al., Development of a whole body physiologically based model to characterise the pharmacokinetics of benzodiazepines. 1: Estimation of rat tissue-plasma partition ratios. Journal of pharmacokinetics and pharmacodynamics, 2004. 31(4): p. 269-298.

Poulin, P., K. Schoenlein, and F.P. Theil, Prediction of adipose tissue: plasma partition coefficients for structurally unrelated drugs. Journal of pharmaceutical sciences, 2001. 90(4): p. 436-447.

Bjorkman, S., Prediction of the volume of distribution of a drug: which tissue-plasma partition coefficients are needed? Journal of pharmacy and pharmacology, 2002. 54(9): p. 1237-1245.

Yun, Y. and A. Edginton, Correlation-based prediction of tissue-to-plasma partition coefficients using readily available input parameters. Xenobiotica, 2013. 43(10): p. 839-852.

Uchimura, T., et al., Prediction of human blood-to-plasma drug concentration ratio. Biopharmaceutics & drug disposition, 2010. 31(5-6): p. 286-297.

httk documentation built on Sept. 11, 2024, 9:32 p.m.