ChemTunes product line
- ChemTunes platform and database for reliable and comprehensive in vitro and in vivo toxicity data and information on human health and regulatory-relevant endpoints
- ToxGPS toxicity knowledgebase for predictions and workflows to support the safety evaluation and risk assessment of chemical compounds
CORINA product line
- CORINA Classic for generating low-energy 3D molecular models
- CORINA Symphony for managing, manipulating and profiling molecular data sets for in silico discovery and optimization experiments
- CORINA_F for interfacing CORINA Classic to the ligand docking program FlexX
- ROTATE Classic for generating conformational ensembles
- SYLVIA for estimating the ease of synthesis of organic compounds
- SONNIA for analyzing and modeling chemical data by neural networks
Free products
- ChemoTyper for searching and highlighting of chemotypes (substructures) in chemical datasets for for grouping, filtering and categorization (houses the ToxPrint chemotype library)
- ToxPrint for profiling chemical datasets with a public library of chemotypes consisting of generic structural fragments, Ashby-Tennant genotoxic carcinogen rules, and cancer TTC categories
- CRAFT for modeling and evaluating the chemical reactivity, persistence and biodegradation of chemicals in the environment
- METIS for input and storage of information about metabolism and degradation reactions