33. Computational and Pharmacoinformatic Approaches to Oral Bioavailability Prediction

  1. Ming Hu3 and
  2. Xiaoling Li4
  1. Miguel Ángel Cabrera-Pérez1 and
  2. Isabel González-álvarez2

Published Online: 5 JUL 2011

DOI: 10.1002/9781118067598.ch33

Oral Bioavailability: Basic Principles, Advanced Concepts, and Applications

Oral Bioavailability: Basic Principles, Advanced Concepts, and Applications

How to Cite

Cabrera-Pérez, M. Á. and González-álvarez, I. (2011) Computational and Pharmacoinformatic Approaches to Oral Bioavailability Prediction, in Oral Bioavailability: Basic Principles, Advanced Concepts, and Applications (eds M. Hu and X. Li), John Wiley & Sons, Inc., Hoboken, NJ, USA. doi: 10.1002/9781118067598.ch33

Editor Information

  1. 3

    Department of Pharmacological and Pharmaceutical Sciences, College of Pharmacy, University of Houston, 1441 Moursund Street, Houston, TX 77030, USA

  2. 4

    Department of Pharmaceutics and Medicinal Chemistry, Thomas J. Long School of Pharmacy and Health Sciences, University of the Pacific, Stockton, CA 95211, USA

Author Information

  1. 1

    Molecular Simulation and Drug Design Department, Centro de Bioactivos Químicos, Universidad Central “Marta Abreu” de Las Villas, Carretera a Camajuaní, Km. 5½, Santa Clara, Villa Clara, C.P. 54830, Cuba

  2. 2

    Department of Engineering: Pharmacy and Pharmaceutical Technology section, School of Pharmacy, Universidad Miguel Hernández de Elche, Carretera Alicante Valencia km 87., San Juan, 03550, Alicante, Spain

Publication History

  1. Published Online: 5 JUL 2011
  2. Published Print: 15 AUG 2011

Book Series:

  1. Wiley Series in Drug Discovery and Development

Book Series Editors:

  1. Binghe Wang

ISBN Information

Print ISBN: 9780470260999

Online ISBN: 9781118067598

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Keywords:

  • computational and pharmacoinformatic approaches - to oral bioavailability prediction;
  • quantitative structure–activity relationship models (QSARS) - human oral bioavailability, modeling ADME properties;
  • physiologically based pharmacokinetic models (PBPK) - ADME prediction and analysis

Summary

This chapter contains sections titled:

  • Introduction

  • General considerations about oral bioavailability predictions

  • Quantitative structure–activity relationship models (QSARS) for prediction of human oral bioavailability

  • Physiologically based pharmacokinetic models (PBPK) for prediction of human oral bioavailability

  • Conclusion and perspectives

  • References