Medicinal Chemistry
Plan reactions, record conditions and search your experimental data
The E-WorkBook Suite enables medicinal and synthetic chemists to plan reactions, record conditions and search their experimental data. Chemistry-specific tools assist in stoichiometric calculations, reaction and structure drawing, task assignment, compound registration and chemically intelligent searching.
Users can automatically calculate properties of compounds, search for precursor and successor reactions and analyze existing data to optimize yield, purity or any other experimental data of choice. E-WorkBook has full support for exact, substructure and similarity searching for molecules and reactions, as well as search by text or numerical data, enabling you to reach your conclusions and generate hypotheses more efficiently.
The extensible nature of E-WorkBook means that you can automatically retrieve test results such as activity and IC50s, see tests run on your compounds and automatically predict physicochemical properties of compounds for optimization. Analytical data can also be embedded directly in your experiments along with Microsoft® Office documents, protein data files and any other data you require – without lengthy and expensive customization.
IDBS were chosen as a partner not only for the power and functionality of their software and flexibility to integrate with utilities developed at Cambridge, but also their willingness to cooperate in the development of novel solutions to underpin chemistry research programmes.
