Terms & Agreements
All of the chemical isomers in the database are available for download, including all of their primary chemical annotations. They are available for download as a collection of gzipped SDF molecular format files, each about 100 MB large.

Note that small subsets of chemicals and isomers are available for download based on specific search criteria are via the ChemicalSearch page.

The data is made freely available for non-profit, academic use only. Agreements with our vendors limits our ability to distribute the data for commercial purposes. If you wish to use the data for commercial purposes, please contact Prof. Pierre Baldi (pfbaldi@ics.uci.edu) first and we may be able to provide a stripped down "raw" version of the data for you.

In either case, to access the download files, submit your contact information below and the download address will be e-mailed to you. We will not distribute your information to any other 3rd party or other marketing purpose, it is only for our internal tracking.

Contact Info

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