Ligand.Info: Molecule Database

Ligand.Info: Molecule Database - download SDF

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Ligand.Info is a compilation of various publicly available databases of small molecules such as ChemBank, ChemPDB, KEGG, NCI, AKos GmbH, Asinex Ltd, and TimTec. The total size of the Meta-Database is 1 million entries. The compound records contain calcula

http://ligand.info/

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2006-03-24, 18🔥, 0💬

Hazardous Substances Data Bank (HSDB) Fact Sheet
HSDB? (Hazardous Substances Data Bank) is a comprehensive, scientifically reviewed, factual database containing records for over 4,900 toxic or potentially toxic chemicals. It contains extensive information in such areas as toxicity, environmental fate, 2006-03-24, ≈14🔥, 0💬

GENE-TOX Fact Sheet
GENE-TOX is a data bank created by the Environmental Protection Agency (EPA) with genetic toxicology test results on over 3,000 chemicals. In the field of genetic toxicology, selected mutagenicity assay systems and the source literature are reviewed by wo 2006-03-24, ≈14🔥, 0💬

The PubChem Project
PubChem provides information on the biological activities of small molecules. It is a component of NIH's Molecular Libraries Roadmap Initiative. 2006-03-24, ≈13🔥, 0💬

ChemIDplus Advanced
ChemIDplus provides access to structure and nomenclature information for the identification of chemical substances cited in NLM databases. The database contains over 379,000 chemical records, of which over 257,000 include chemical structures. ChemIDplus L 2006-03-24, ≈13🔥, 0💬

Chemical Entities of Biological Interest (ChEBI)
Chemical Entities of Biological Interest (ChEBI) is a freely available dictionary of molecular entities focused on ?small? chemical compounds. The term ?molecular entity? refers to any constitutionally or isotopically distinct atom, molecule, ion, 2006-03-24, ≈12🔥, 0💬

Chemical Carcinogenesis Research Information System Fact Sheet
CCRIS (Chemical Carcinogenesis Research Information System) is a factual data bank sponsored by the National Cancer Institute. It contains evaluated data and information, derived from both short and long-term bioassays on over 8,900 chemicals. Studies rel 2006-03-24, ≈12🔥, 0💬

ZINC is not commercial - A free database for virtual screening
Welcome to ZINC, a free database of commercially-available compounds for virtual screening. ZINC contains over 3.3 million compounds in ready-to-dock, 3D formats. ZINC is provided by the Shoichet Laboratory in the Department of Pharmaceutical Chemistry at 2006-03-24, ≈12🔥, 0💬

HIC-Up
Welcome to HIC-Up, the Hetero-compound Information Centre - Uppsala, a freely accessible resource for structural biologists who are dealing dealing with hetero-compounds ("small molecules"). This service is provided and maintained by Gerard Kleywegt at th 2006-03-24, ≈12🔥, 0💬

Search by structure database of available compounds - BioScreeni
Search 600,000 + Structures of Available Compounds and Submit Inquiry Online! If you are asked to install Java plug-in, click yes, download and install Java. When you are asked to grant JChem Java session, click "Grant Always". No registration. No subscri 2006-03-24, ≈11🔥, 0💬

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