User support in searching, processing and analyzing chemical information. Test the platform's features for free

Modular artificial intelligence platform for organic and medicinal chemistry

1.7 mln

Experimental data

15 mln

Patents

1.3 mln

Reactions

160 mln

Literary sources

155 mln

Molecules

The Syntelly database is compiled from open sources and consists mostly of small molecules. Data from the following sources are included in the literature: USPTO, WIPO, FIPS, PMC, Crossref

Database

Enter structures and view predicted properties for structures that are not in the Syntelly database: physicochemical, biological properties, carcinogenicity and drug similarity parameters

Molecular Editor

PDF2SMILES

Tool for optical recognition of molecular structures and Markush structures from PDF. Export structures from documents to a separate dataset for further analysis

Navigating the chemical space. Analyzing clusters of bioactive compounds. Generation of new compounds with specified properties.

SynMap 2D / 3D

Prediction of spectra: tandem mass spectrometry (QToF-MS/MS), infrared spectroscopy and nuclear magnetic resonance (1H, 13C, 15N, 19F)

Spectra

Collect and store your own chemical datasets. Import and export is available in the most popular formats: SDF, CSV, SMI. We also provide a collection of thematic datasets

Datasets

Predicting reactions

Prediction of possible products of chemical reactions and search for reactions for the synthesis of the desired molecule based on a neural network model

Compounds properties prediction

Evaluation of compounds using 80 models to predict physicochemical, toxicological and biological properties of organic compounds

Modules

Generation of systematic nomenclature names according to the IUPAC

Quick search for relevant and reliable information related to chemistry: structures, literature, patents, experimental data

Choosing the optimal synthesis path with calculation of economic efficiency. TOP 5 known reaction schemes, including all stages and references to literary sources

Our technologies implemented and applied by

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