ADMET & PhysChem Symposium

October 22, 2009

Schlosshotel Bühlerh&ooml;he, Baden-Baden, Bühl, Germany

Related Materials

Related presentations, posters, and scientific talks from this event have been posted here for your reference. Please click the associated link to download.

Title Author Link
Integrated ADME Risk Assessment in Lead OptimizationDr. Bernard Faller (Novartis Pharma AG)Download the presentation (751 Kb PDF file)
Ionization-Specific Analysis of Human Intestinal AbsorptionDr. Derek Reynolds (REYTEK Limited)Download the presentation (1.1 Mb PDF file)
Novel Uses of pKa and ADME/Tox Calculation in Medicinal Chemistry PlanningDr. Chris Lipinski (Melior Discovery, USA)Download the presentation (666 Kb PDF file)
Obtaining Solvation Descriptors For Ions and Ionic SpeciesM. Abraham (University College London)Download the presentation
pKa Expert Training and Automation Eduard KolovanovDownload the presentation (546 Kb PDF file)

Agenda

8:00 AM   Registration

Welcome and Introduction, Daria Thorp (President, ACD/Labs)

Morning Session—PhysChem

Obtaining Solvation Descriptors For Ions and Ionic Species, Prof. Mike Abraham (University College London)

Aqueous Solubility Prediction—Our Approach & Future Development, Pranas Japertas (ACD/Labs)

Coffee Break

pKa—Automation and Expert Training, Eduard Kolovanov (ACD/Labs)

Round-table—Solubility

Lunch Break

Afternoon Session—ADMET and ACD/Structure Design Suite

Integrated ADME Risk Assessment in Lead Optimization, Dr.Bernard Faller (Novartis Pharma AG)

ADMET Prediction and Expanding Our Structure Design Solution, Pranas Japertas (ACD/Labs)

Coffee Break

Novel Uses of pKa and ADME/Tox Calculation in Medicinal Chemistry Planning, Dr. Chris Lipinski (Melior Discovery, USA)

Ionization-Specific Analysis of Human Intestinal Absorption, Dr. Derek Reynolds (REYTEK Limited)

Software Demonstration & Case Studies, Karim Kassam (ACD/Labs)

Round-table—Structure Design Suite and an Enterprise Solution for ADMET

5:00 PM   Concluding Remarks, Daria Thorp (ACD/Labs)