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Welcome to ZINC, a free database of commercially-available compounds for virtual screening. ZINC contains over 35 million purchasable compounds in ready-to-dock, 3D formats. ZINC is provided by the Irwin and Shoichet Laboratories in the Department of Pharmaceutical Chemistry at the University of California, San Francisco (UCSF).
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The ZINC database (recursive acronym: ZINC is not commercial) is a curated collection of commercially available chemical compounds prepared especially for virtual screening. ZINC is used by investigators (generally people with training as biologists or chemists) in pharmaceutical companies, biotechnology companies, and research universities.
Some things to try. ZINC IDs: One or more ZINC IDs. SMILES: Search for compounds by SMILES (and optional similarity percentage) Ring Name: Search for compounds by component ring names. Drug Name: Common, street and systematic drug/compound names. CAS/MDL Number.
A key barrier to entry in virtual screening is the inaccessibility of a database to screen. We present here a new research tool suitable for both novices and experts to address this deficiency. The ZINC database provides 3D molecules in several formats compatible with most docking programs.
ZINC-22 is a free database of commercially-available compounds for virtual screening. ZINC-22 focuses on make-on-demand ("tangible") compounds from a small number of large catalogs: Enamine, WuXi and Mcule.
Aug 26, 2017 · ZINC is a free database of commercially-available compounds for virtual screening. ZINC contains tens of millions of purchasable compounds in ready-to-dock, 3D formats.
May 15, 2012 · Tables summarizing the contents of commercial catalogs and annotated databases in ZINC, filtering rules, a guide to the ZINC query construction syntax including some sample query scripts, a quick search bar guide, how to link to ZINC, and a description of the ZINC processing pipeline.
Jul 23, 2012 · ZINC is a free public resource for ligand discovery. The database contains over twenty million commercially available molecules in biologically relevant representations that may be downloaded in popular ready-to-dock formats and subsets.
Ready-to-download subsets of ZINC filtered by physical properties are available below. All molecules in all of these subsets are purchasable. To go to the download page, click on the subset name.
