Alternatives to InfoChem
Compare InfoChem alternatives for your business or organization using the curated list below. SourceForge ranks the best alternatives to InfoChem in 2026. Compare features, ratings, user reviews, pricing, and more from InfoChem competitors and alternatives in order to make an informed decision for your business.
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ChemicalSafety
Chemical Safety Software
ChemicalSafety offers a comprehensive suite of environmental health and safety software applications. Features include GHS Labeling, Safety Data Sheets, Chemical Inventory Tracking, Hazardous Waste Management, Environmental Regulatory Reporting, and Employee Workplace Safety & Compliance. Everything you need to track your chemical inventory and hazardous waste from beginning to end. EMS addresses all of the special issues associated with storing, using, and disposing of hazardous materials. Safety Data Sheets: Manage and Distribute SDS's Online. A cloud-based safety data sheet management solution. Easy online access for all employees. Monitor and manage all aspects of employee and workplace safety including safe storage and use of chemicals, alerts and notifications, employee training requirements and site incident tracking with corrective actions. -
2
Mar-Kov
Mar-Kov Computer Systems
Mar-Kov is a leading provider of cost-effective software solutions for the pharmaceutical, chemical, cosmetics, flavors and fragrance, paints and coatings, and food industries. Delivering robust traceability solutions for process, batch, and formulation-based manufacturers, Mar-Kov helps businesses automate daily routine processes and streamline their operations while adhering to requirements of the HACCP, FDA, and other regulatory requirements. The solution also promotes paperless inventory by leveraging barcoding and an electronic batch recording system.Starting Price: $200/month -
3
Reaxys
Elsevier
Reaxys is a web-based tool developed by Elsevier for retrieving information about chemical compounds and data from published literature, including journals and patents. The platform provides access to chemical compounds, reactions, properties, related bibliographic data, substance data with synthesis planning information, and experimental procedures from selected journals and patents. Launched in 2009 as the successor to the CrossFire databases, Reaxys was designed to offer research chemists access to current and historical information in organic, inorganic, and organometallic chemistry through an intuitive interface. The platform covers over 200 years of chemistry, abstracted from thousands of journal titles, books, and patents. Its content includes data from selected journals and chemistry patents, focusing on entries that have a chemical structure, are supported by experimental facts, and have credible citations. -
4
Torx
Cresset Group
Make better design decisions and track compound synthesis from start to finish with ease. Torx is a visual, chemistry aware, web-based platform that inspires discovery chemistry teams to work together and deliver faster. Dedicated stand-alone modules for Design, Make, Test and Analyze that work in synergy to deliver a complete discovery cycle platform. Design molecules faster, capture and share knowledge, and manage resources with ease. Collaborative team working and information delivery for all roles in the DMTA cycle. However you refer to it, 'Design-Make-Test-Analyze' or 'Design-Synthesize-Test-Analyze', all small molecule chemistry teams go through a common process: design molecules, make or synthesize compounds, then test and analyze the results before the next iteration; it’s the mantra of chemistry teams all over the world. -
5
ChemCopilot
ChemCopilot
ChemCopilot is an AI-native chemical formulation and product lifecycle management platform designed to transform how scientists, engineers, and R&D teams design, test, optimize, and manage chemical products and processes by combining advanced artificial intelligence with domain-specific chemistry knowledge, regulatory data, simulation capabilities, and real-time insights. It automates validation of product labels, ingredient restrictions, and safety data sheets against global compliance frameworks, eliminating disconnected spreadsheets and manual review while providing audit trails and real-time alerts to support regulatory adherence. ChemCopilot accelerates innovation by simulating chemical reactions, molecular interactions, and process workflows to predict formulation performance and outcomes that traditional general-purpose tools cannot provide, and it integrates real-time data from laboratory and industrial systems to drive data-driven decisions. -
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BIOVIA COSMO-RS
Dassault Systèmes
BIOVIA COSMO-RS is a comprehensive toolbox for modeling and predicting fluid phase properties, enabling chemical engineers, chemists, formulation engineers, and materials scientists to research and develop new solutions faster and more efficiently than with test and experimentation alone, thus accelerating innovation and reducing costs. COSMO-RS simulations are based on a sound scientific theory, which ensures robust and reliable predictions over the whole range of chemistry in the liquid state. The first-principle approach allows for predictions of new, not yet synthesized compounds, reaching beyond the known chemical space. BIOVIA’s COSMO team consists of the original inventors of COSMO-RS, assuring timely support and prime expertise to help solve even the most challenging problems in solution thermodynamics. Key benefits include a robust scientific foundation combining quantum chemistry and thermodynamics to ensure accuracy and reliability. -
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BIOVIA TURBOMOLE
Dassault Systèmes
BIOVIA TURBOMOLE is a high-performance quantum chemistry software package designed for ab initio electronic structure calculations across molecules, clusters, periodic systems, and solutions. Developed initially by the University of Karlsruhe and Forschungszentrum Karlsruhe GmbH, and now maintained by TURBOMOLE GmbH, it offers a comprehensive suite of computational methods, including density functional theory (DFT), Møller–Plesset perturbation theory, coupled-cluster techniques, and GW-Bethe–Salpeter methods. It excels in delivering accurate predictions for chemical reactions, spectroscopy, and optical device simulations, with features like reaction path optimizations, transition state searches, and solvation effects modeled using COSMO-RS. Spectroscopic capabilities encompass IR, Raman, VCD, UV-Vis, and vibronic spectra, while optical property simulations benefit from advanced spin-orbit coupling methods and relativistic all-electron calculations. -
8
MolPad
MolPad
MolPad integrates an interactive chemistry sketcher into any online learning platform. Build open questions about molecular structure and organic chemistry that go beyond just recognizing the right answer. Discover how MolPad can enrich online chemistry education by providing a low code environment for creating dynamic content and smart assessment. With MolPad, we have developed several solutions for interactive and intuitive drawing of structural formulas, enabling the student to practice with topics like chemical naming, functional groups, and Lewis structures in a digital environment. By providing smart feedback based on specific errors, the student can gain more insight than with multiple choice questions. -
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iChemistry
Intersolia
Since 1999, we’ve been providing our customers with the market’s most complete chemical management solution, developed in collaboration with our customers and our market-leading experts. iChemistry is our cloud-based solution for the end users in the chemical management supply chain. Our software helps you manage environmental, health, and safety performance, ensure compliance, minimize risk, and improve profitability. Create and distribute safety sheets so that you can identify risks, prevent accidents, and reduce workplace hazards. Comply with government requirements such as REACH or GHS. Become more sustainable by working proactively to reduce hazardous chemicals. Increase efficiency and control, so that you can free up more time and resources. With iChemistry, you also get access to our integrated SDS service that has one of Europe’s largest databases for safety data sheets. All of our SDS are digitized, which means that you get instant access to all essential information.Starting Price: Free -
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NobleAI
NobleAI
NobleAI enables companies to accelerate the development of better-performing, more environmentally sustainable, and reliably sourced chemical & material products. At NobleAI, we believe that materials science and chemistry are key to building a sustainable world and that AI is essential to unlock this potential. NobleAI’s science-based AI is a powerful fusion of novel artificial intelligence techniques and all available scientific knowledge, optimized for product development. This combination of data-driven insights and scientifically guided design delivers much higher levels of accuracy with far less data and training time. This delivers deeper insights while exhibiting greater transparency, interpretability, and scientific fidelity. -
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Khimera
Kintech Laboratory
Khimera is used to calculate the kinetic parameters of microscopic processes, thermodynamic and transport properties of substances and their mixtures in gases, plasmas and gas-solid phases boundary. The primary users are researchers and engineers, involved in kinetic model development as well as thermodynamic and kinetic modeling for chemical engineering, combustion, catalysis, metallurgy, and microelectronics areas. Khimera ideally fits the needs of multi-scale modeling providing the link between fundamental molecular properties of individual molecules and mesoscale ensemble-averaged characteristics of the reactive medium: thermodynamic and transport properties as well as rates of chemical reactions. All the models can use the results of quantum-chemical simulations as an input, thus providing the possibility to recover properties without any experimental input from the user side. -
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SciveraLENS
Scivera
Screen formulations for sourcing and product development. Use our 23 toxicological endpoint system to proactively identify potential issues and find safer alternatives. Understand your company’s chemical footprint. Manage compliance and certification requirements automatically. Simplify data gathering, list-screening, and chemical hazard assessments with an easy-to-understand interface. Benefit from the world’s largest Safer Chemistry Knowledge Base with more than 4,000 Verified Chemical Hazard Assessments from Scivera’s board-certified toxicologists. Build a configurable plan to fit your needs and budget. Whether you’re a supplier or a brand, feel confident submitting or receiving chemical reports with redacted information that protects intellectual property while providing necessary chemical safety information. -
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Ansys Chemkin-Pro
Ansys
Ansys Chemkin-Pro is the industry leader for modeling complex, chemically reacting systems. It has been extensively validated in numerous chemistry applications and is well known for its extremely fast simulation time. Today’s energy standards call for high yields, efficiency and quality with minimal byproduct or waste. Ansys Chemkin-Pro is a chemical kinetics simulator that models idealized reacting flows and provides insight into results before production testing. Relying on testing alone for verifying chemical processes is prohibitive, given today’s shortened design cycles. Effective simulation is critical for cost-effective designs and gets your product to market faster. Mitsuo Koshi is a world-renowned chemical kineticist who also happens to be an avid fireworks fan. He is responsible for judging prestigious fireworks competitions across Japan. Every year, firework displays become grander and more fantastic, but this is paired with increased emissions. -
14
GPT-Rosalind
OpenAI
GPT-Rosalind is a purpose-built frontier reasoning model developed by OpenAI to accelerate scientific research across biology, drug discovery, and translational medicine. It is designed specifically for life sciences workflows, where researchers must navigate large volumes of literature, experimental data, and specialized databases to generate and validate new ideas. It combines deep domain understanding in areas such as chemistry, genomics, protein engineering, and disease biology with advanced tool-use capabilities, allowing it to interact with scientific databases, analyze experimental outputs, and support complex, multi-step reasoning tasks. It can assist with evidence synthesis, hypothesis generation, literature review, sequence interpretation, and experimental planning, helping scientists move faster from raw data to actionable insights. GPT-Rosalind transforms complex, time-intensive research processes into more efficient AI-assisted workflows. -
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AQChemSim
SandboxAQ
AQChemSim is a cloud-native platform developed by SandboxAQ that leverages Large Quantitative Models (LQMs) grounded in physics and chemistry to revolutionize materials discovery and optimization. By integrating Density Functional Theory (DFT), Iterative Full Configuration Interaction (iFCI), Generative AI, Bayesian Optimization, and Chemical Foundation Models, AQChemSim enables high-fidelity simulations of molecular and material behaviors under real-world conditions. AQChemSim's capabilities include predicting performance under various stresses, accelerating formulation through in silico testing, and exploring sustainable chemical processes. Notably, AQChemSim has demonstrated significant advancements in battery technology by reducing lithium-ion battery end-of-life prediction time by 95%, achieving 35x greater accuracy with 50x less data. -
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ChemInventory
Antipodes Scientific
ChemInventory helps you organize your laboratory's chemical stock, cutting the time spent by your group members searching for compounds, and letting them get on with their work. ChemInventory is secure, cloud-based software that allows you to manage the chemical containers in your laboratory. You and your research group members can search instantly for compounds by name, CAS registry number, structure or any number of your own custom fields. Chemical structures are presented alongside other relevant information in search results. ChemInventory can be accessed from any device - including PCs and Macs. You no longer need to have your inventory tied to a single computer. All data stored on our servers is encrypted using the industry standard AES-256 algorithm. To protect against data loss, we backup our databases daily. Unique barcodes can be assigned to each container, enabling simple and fast stocktaking procedures with a barcode scanner.Starting Price: $56 per year -
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Chemaxon Design Hub
Chemaxon
A platform that connects scientific rationale, compound design, and computational resources. Chemaxon’s Design Hub for medicinal chemistry from analysis to prioritize ideas. Design Compounds and manage ideas within one platform. A single platform that connects scientific rationale, compound design, and computational resources. Switch from PowerPoint files to graphical and chemically searchable hypotheses that are an integral part of the compound design process. Easily work with your trusted phys-chem properties, computational models, novelty issues, or purchasable compound catalogs in a rich visual environment. Involve your CROs in the compound progression process using this secure online service. Analyze collected evidence from biological assays or experimental structural information, extract SAR, and make new hypotheses for the next optimization iteration. Store your scientific hypotheses in a “designer's ELN” (chemically aware drawing canvases). -
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ChemDraw
PerkinElmer
Since 1985 ChemDraw® solutions have provided powerful capabilities and integrations to help you quickly turn ideas and drawings into publications you can be proud of. A chemistry communication suite, ChemOffice+ Cloud transforms your chemical drawings into chemical knowledge by facilitating the management, reporting and presenting of your Chemistry research. ChemOffice+ Cloud, is a robust, comprehensive suite, purpose-built to simplify, facilitate, and accelerate chemistry communication. The cloud-native chemistry communication suite builds on the foundations of ChemDraw Professional and adds access to a powerful set of tools to enable scientific research. The mundane task of creating reports to communicate chemical research has become much more efficient with ChemOffice+ Cloud. With powerful capabilities to search, reuse, select, and organize chemical structures and data, chemists can use ChemOffice+ Cloud to create presentation-ready PowerPoint slides and manuscripts. -
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Tox Suite
ACD/Labs
Calculate drug toxicity and safety endpoints to reduce attrition rates of molecular entities that are unlikely to succeed to nomination as a drug candidate, direct new compound synthesis, and focus animal testing requirements. -
20
LabCup
LabCup
The complete chemical inventory software and laboratory management enterprise system for industry and research universities. LabCup provides complete laboratory and research institution software management systems. From full chemical inventory software, risk assessment/COSHH, equipment booking, and asset inventory, to live emergency information, LabCup covers a huge range of functionality. LabCup is fully modular, users can choose which modules they require, and is cloud based so available on any device. Designed for the users, to minimise administration and automate procedures – LabCup automatically pulls in chemical data (SDS, GHS, all synonyms, structure, emergency information, and much more) – and this is all used throughout the system, with every chemical and item on the system tracked uniquely by barcode/ID. Multiple processes (including COSHH risk assessment, equipment and room bookings, training records, digital fire registry, purchasing, radioactives, and much more). -
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Chematix
Chematix
The full-spectrum chemical management solution designed to meet the specific requirements and responsibilities of scientists, researchers, regulatory officials and administrators in education, government and industry. Comprised of modules to handle: Web Procurement of chemicals and supplies, complete life cycle chemical tracking, chemical inventory management and regulatory control, waste management and regulatory compliance, financial management and auditing, resource management and system security. On-line ordering process with shopping cart feature. Built-in product search feature accessing central stores, in-house stockrooms and major vendor catalogs: Fisher, Sigma Aldrich and VWR Scientific. The ability to track every on-site chemical to an exact location assistance with compliance with health and environmental regulatory guidelines. Chemical Abstract Database (CAD) to maintain data integrity. -
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BIOVIA COSMOtherm
Dassault Systèmes
BIOVIA COSMOtherm is an advanced COSMO-RS implementation that combines quantum chemistry and thermodynamics to predict thermodynamic properties of liquids. It calculates the chemical potential of molecules in pure or mixed liquids across variable temperatures, enabling the prediction of properties such as solubility, partitioning, vapor pressure, and phase diagrams. Unlike other methods, COSMOtherm applies thermodynamically consistent equations to predict properties as functions of concentration and temperature. Key features include the ability to predict solubility of liquids, solids, and gases; activity coefficients; two-phase partitioning (e.g., LogP); phase behavior; vapor pressures; free energy of solvation; pKa; energy of transfer to liquid-liquid interfaces; micelle and membrane partitioning; and interfacial tension. COSMOtherm offers an easy-to-use graphical interface and a command-line version for seamless integration into existing workflows. -
23
BIOVIA
Dassault Systèmes
BIOVIA solutions create an unmatched scientific management environment that can help science-based organizations create and connect biological, chemical and material innovations to improve the way we live. The industry-leading BIOVIA portfolio is focused on integrating the diversity of science, experimental processes and information requirements end-to-end across research, development, QA/QC and manufacturing. Capabilities over the areas of Scientific Informatics, Molecular Modeling/Simulation, Data Science, Laboratory Informatics, Formulation Design, BioPharma Quality & Compliance and Manufacturing Analytics. BIOVIA is committed to enhancing and speeding innovation, increasing productivity, improving quality and compliance, reducing costs and accelerating product development for customers in multiple industries. Manage and connect scientific innovation processes and information across the product lifecycle. -
24
InQuanto
Quantinuum
Quantum computing offers a path forward to rapid and cost-effective development of new molecules and materials. InQuanto, a state-of-the-art quantum computational chemistry platform, represents a critical step toward this goal. Quantum chemistry aims to accurately describe and predict the fundamental properties of matter and hence is a powerful tool in the design and development of new molecules and materials. However, molecules and materials of industrial relevance are complex and not easy to accurately simulate. Today’s capabilities force a trade to either use highly accurate methods on the smallest-sized systems or use approximating techniques. InQuanto’s modular workflow enables both computational chemists and quantum algorithm developers to easily mix and match the latest quantum algorithms with advanced subroutines and error mitigation techniques to get the best out of today’s quantum platforms. -
25
Alchemy Cloud
Alchemy
Alchemy is an enterprise SaaS company helping to modernize the $1 trillion global specialty chemicals industry. Alchemy helps specialty chemicals companies accelerate their formula development and commercialization processes, be more responsive to customers, and grow top line revenue. With Alchemy's Chemistry Acceleration Software, customers increase lab capacity, accelerate chemistry innovation, and grow sales. From concept to chemistry, Alchemy accelerates product development and improves service delivery for chemicals and materials companies. Whether you’re working on fundamental R&D, new products or helping customers get the most from your current products, Alchemy accelerates your lab, sales and service processes so you can speed time to revenue on new product development, decrease lab cost per sale and improve customer responsiveness. Industry-specific software to accelerate chemistry development, sales and service. -
26
PhysChem Suite
ACD/Labs
Calculate physicochemical properties such as aqueous solubility, boiling point, logD, logP, pKa, Sigma, and other molecular descriptors for organic compounds, from chemical structure. -
27
ProSimPlus
Fives ProSim
ProSimPlus is a chemical process simulation software very intuitive and easy to use, so users adopt it very quickly. The software is a solution that is widely used by the world’s leading oil, gas, chemicals, energy or bio-based industry companies. Fives ProSim offers process simulation software and services that allow industries to improve their operations, increase their profitability or reduce their environmental impact. For more than 30 years Fives ProSim has been designing and developing process simulation and optimization software in the oil, gas, chemical, pharmaceutical, energy and other process industries. Fives ProSim is today at the heart of two challenges that the industry must face to remain competitive: the digital transition and the energy transition. Fives ProSim stands out thanks to the ease of use of its software, the responsiveness of its support team. -
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Avogadro
Avogadro
Avogadro is an advanced molecule editor and visualizer designed for cross-platform use in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible high quality rendering and a powerful plugin architecture. Avogadro is a free, open-source molecular editor and visualization tool, designed for use on Mac, Windows, and Linux in computational chemistry, molecular modeling, bioinformatics, materials science, and related areas. It offers flexible high quality rendering and a powerful plugin architecture. -
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EcoOnline
EcoOnline
Through a comprehensive platform, EcoOnline offers all the modules that a company needs to create safe, compliant and efficient workplaces. The functionally rich integrated platform ensures real-time decision support and EHS analytics, drive efficiency, whilst safeguarding your workforce, customers, and company reputation. With EcoOnline’s digital solutions, following safety management best practices is easy, effective and even inspiring. Use our mobile app to engage employees and build a lasting safety culture. The most user-friendly chemical safety software on the market that gives control back to employees who manage chemical safety. Take control of your SDS Management, Risk Assessments and Chemical Reporting. EcoOnline's Environmental Reporting Software modules allow you and your organization to track and reduce organizational emissions, optimize raw material usage and automate and schedule regular reports. -
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NEMS Chemical
NEMS
NEMS Chemicals is a hassle-free solution for managing HOCNF (Harmonized Offshore Chemical Notification Format) documentation. It's a cloud-based service, which means you don't need to install any software. All you need is a modern web browser to access it. By using NEMS Chemicals, oil and gas operators can reduce their workload when it comes to preparing discharge applications and reports. Chemical suppliers will also benefit from the solution, as it simplifies the process of HOCNF documentation and registration. NEMS Chemicals is developed and operated by NEMS and our KPD (Chemical Product Data) center. NEMS Chemicals is used for the environmental management of offshore chemicals. NEMS Chemicals is designed to register information on chemical products and their substances. This includes physical properties, hazard labeling, and eco-toxicological properties. The tool has the possibility to print out complete HOCNF reports. -
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Yordas Helix
Yordas Group
Welcome to Yordas Helix, our proactive product risk and regulatory intelligence management system. Helix is designed to help you take control of market access and change, and gain transparency across your supply chains globally. Created as a reflection of our company values, Helix brings together our scientific and industry knowledge and our collaborative spirit to deliver an innovative solution to help you overcome your regulatory challenges. We want to provide you with an easy-to-use platform that is tailored to your specific business needs. Helix is more than a name; it's a symbol of our dedication to data-driven innovation. It unites our expert consulting with an interactive digital solution to deliver unparalleled insight into continuous chemical compliance and risk management. Helix brings together your product information with our wealth of regulatory experience and compliance data and empowers you with the ability to evaluate the impact of change on your products and business. -
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GreenCheck Software
APA Engineering
Maintaining compliance standards for Substance of Very High Concern (SVHC) for companies producing chemicals or chemical-containing products is an ongoing challenge. Manual processes are fast becoming tedious, complex with growing requirements and evolving supply chain and not easy to scale up. Scale-up & manage peak loads during submissions and new product introductions. Managing complex and large supply chains with relentless follow-up with suppliers. APA Engineering with over 19+ experience in ‘product chemical compliance and a global client base has built this web-based SaaS platform to reduce costs & time and achieve comprehensive compliance reporting. Greencheck software automates most of the critical product chemical compliances. One-click email to get the chemical composition. Vendors can upload directly even via excel. Comprehensive compliance reporting, a single dashboard for all product chemical regulations. -
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Chemical Watch
Chemical Watch
Chemical Watch is the leading global provider of independent intelligence and insight for product safety professionals managing chemicals. Chemical Watch is the world’s most valued chemical safety and regulatory intelligence network and trusted partner to a global community of businesses, regulators and other stakeholders. Join the Chemical Watch community today to empower your business. Comprehensive structured product compliance data solution providing coverage of product regulations across all jurisdictions, including legal documentation, expert analysis and summaries. Attend our virtual conferences to take part in interactive question and answer sessions, ‘ask the expert’ themed networking tables and informative presentations, all from the comfort of your home or office. Network with fellow delegates and conference speakers in our dedicated virtual networking areas – just like you would at a live event. -
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Arxspan
Arxspan
Arxspan's Electronic Lab Notebook is a fully integrated cloud platform for scientific data management that combines chemistry and biology data in one system. It is perfectly designed to enhance collaborative research across internal teams & external partners. Support for chemistry and biology experiments and workflows in single cloud ELN. Keyword, advanced, and chemical searching. Attachment and in-line editing for all Microsoft Office, image, and instrument files. Deployment in the private, secure Arxspan Cloud environment eliminates costly hardware acquisition, maintenance and IT overhead. Out of box integration with legacy electronic laboratory notebook systems. View and/or write sharing capabilities at notebook and project level. Configurable user role and permission hierarchies. Experiment signing and witnessing workflows. SAFE BioPharma compatibility for multi-factor capabilities. Support for validation of system and system updates. -
35
ChemOffice
PerkinElmer Informatics
ChemOffice enhances scientists’ personal productivity and helps them do better science by enabling them to organize and explore their compounds, reactions and associated properties so that data can be turned into actionable information, and decisions can be made with greater confidence. ChemDraw for Excel adds chemical intelligence to Excel spreadsheets so that chemists can use Excel’s analysis, sorting and organization tools to further manipulate and enrich sets of compounds and data and explore structure-activity relationships. Chem3D generates 3D models so that chemists can view their compounds in three dimensions to assess shape and properties to maximize activity or specificity. ChemFinder is a chemically-intelligent personal database system that scientists use to organize their compounds and to search for and correlate structures with properties. -
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REACH Factory
EcoMundo
REACH Factory is an all-in-one, modular, cloud-based and fully interfaceable with your IS software for all industries where traceability and management of chemical substances have become a requirement. With its regulatory knowledge base on 380 global regulations and 300,000 chemical substances, REACH Factory is at the heart of the CSR policy of companies. Its SDS Factory module ensures the creation of your SDSs in record time. Their global compliance, local adaptation and translation are managed directly by the software with the latest updated versions. Its PDF Reader module can assist in the digitization of data and accelerate the management of MSDSs within the enterprise, freeing teams for more essential tasks. Complemented with its SAFE Factory module, chemical risk management is simplified and automatable. The same goes for the calculation of the forecasted and actual ICPE/SEVESO status, which is automated according to the digitized data of the SDS and the stored quantities. -
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alvaBuilder
Alvascience
alvaBuilder is a no-code de novo molecular design software for generating novel chemical structures that satisfy user-defined structural, physicochemical, and modeling constraints. It enables the creation of new molecules starting from scratch or by evolving existing structures using fragment-based and rule-driven approaches. alvaBuilder integrates seamlessly with QSAR/QSPR workflows, allowing users to guide molecule generation using predictive models, descriptor ranges, and property targets. The software supports medicinal chemistry, lead optimization, and virtual screening tasks by efficiently exploring chemical space while maintaining chemical feasibility and interpretability. alvaBuilder is designed for research and industrial applications where transparent, controllable, and reproducible molecular generation is required. -
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CLADE
CLADE
CLADE is revolutionizing bioanalytics by simplifying the complex process of chemical analysis through a unique combination of chemometrics and state-of-the-art spectroscopic technology. It delivers fast, accurate, and reproducible results, transforming liquid samples into digital fingerprints in just four minutes. At the core of CLADE's technology is the MIRA Analyzer, which records exceptionally precise mid-infrared spectra of aqueous samples in transmission mode over the analytically relevant wavenumber range. MIRA's automated features include sample and reference injection, correction of atmospheric influences, determination of optical path length, and cleaning and rinsing of the entire system, ensuring superior data quality. Complementing MIRA is CLADE's Sphere, a cloud-based platform designed to simplify bioanalytics. -
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Chemdoc
EcoOnline
Manage your COSHH Risk Assessments and SDS, the smart way. Software to get your chemical safety organized and compliant. Simply tell us what products you have in your inventory and we do the rest, Safety data sheet management simplified. We work with you to build customizable COSHH Risk Assessment templates that work for your organization. Our online platform allows you to complete chemical safety reports which can be distributed to all employees within your business. Chemdoc is a chemical safety management software that saves you money and time. Chemdoc gives control back to those managing chemical safety by directly sourcing Safety Data Sheets from the manufacture on your behalf and supplying you with the tools to complete custom and relevant COSHH Risk assessments which will be complaint and also to ensure the safety of your employees. -
40
LabSoft LIMS
Computing Solutions
Since 1989 Computing Solutions, Inc. (CSI) has been providing LabSoft LIMS exclusively to the Chemical, Manufacturing, Food & Beverage, Energy, Agriculture, and Petrochemical industries. Along with the industry focus, LabSoft LIMS software is a full featured, highly configurable laboratory information management system (LIMS) that boasts built-in tools and the ability to collaborate with other digitized business systems (e.g. OSIsoft’s PI, Microsoft Dynamics AX). LabSoft LIMS' comprehensive feature set empowers you to build an integrated solution that fully exploits your laboratory data yielding higher quality and reduced costs. In addition to providing all the standard features of a laboratory information management system, LabSoft LIMS is distinguished in its configuration capability. LabSoft LIMS recognizes the need to provide unique sampling types and processes. With LabSoft LIMS, QC, in-process, lot/batch, tanks, finishing samples, etc. -
41
Chemcad
Chemstations
Chemstations' integrated suite of intuitive process simulation software fuels productivity for chemical engineering projects. Give CHEMCAD NXT a comprehensive test run and find out how our process simulation software guides you intuitively through detailed system design, analysis, and reporting. Try CHEMCAD for free today and find out how easily you can simulate simple and complex chemical processes on one intuitive, graphical interface. Take advantage of comprehensive CHEMCAD training services ranging from basic and advanced training courses to informative videos and webinars. We created CHEMCAD to empower the role of chemical engineers across industry. To enhance their design, analysis, and testing capabilities so they can drive productivity throughout their organizations. With flexible pricing options, we have a solution to fit every need. CHEMCAD enables you to meet the ever-expanding needs of the chemical engineering profession. -
42
Confience myLIMS
Confience
Confience myLIMS is an advanced Laboratory Information Management System (LIMS) designed to streamline and enhance laboratory operations across various industries, including water, wastewater, food and beverage, manufacturing, and chemical. This comprehensive software solution enables labs to efficiently manage samples, automate workflows, ensure data accuracy, and maintain compliance with regulatory or industry standards such as FDA 21 CFR Part 11, TNI/NELAC, EPA, ISO 17025 or GLP/GMP guidelines. Labs can leverage Confience myLIMS to optimize their processes, from sample collection and tracking to analysis and reporting, ensuring that they meet regulatory requirements while delivering high-quality results. One of the standout benefits of Confience myLIMS is its ability to drive continuous improvement within lab environments. By automating routine tasks and providing a centralized platform for data management, labs can focus on enhancing their analytical capabilities and improving TAT. -
43
Knowde
Knowde
Knowde is a vertical AI and software platform purpose-built for the chemical, ingredient, and polymer industry. It provides a clean, structured data foundation by automatically harmonizing supplier and product data (e.g., material specifications, regulatory, performance metadata) that powers downstream tools such as ERP, CRM, AI, ecommerce, and master data systems. On top of that data layer sits the Knowde Customer Experience Platform, a turnkey solution allowing chemical suppliers to operate branded, B2B digital storefronts integrated with product catalogs, search, sampling, quoting, and content. In parallel, Knowde hosts a marketplace where buyers can search, compare, sample, quote, and purchase from 8,000+ supplier-owned storefronts across over 230,000 ingredients, polymers, and raw materials worldwide, all with technical documentation, supplier insights, and procurement tooling. -
44
ChemOne
YASH Technologies
Chemical companies are witnessing transformational shifts in their business landscape with margin pressures, changes in how their customers want to use and pay for their products, and the need for strategic agility to shrink cycle/lead times in response to market dynamics. In the Chemical industry, only frictionless processes, 100% plant availability, and maximum reliability can ensure competitiveness. As a leading SAP Partner, YASH’s SAP Centre of Excellence leverages technology and flexible business models to drive innovation and value throughout your chemical enterprise. Optimize the entire process from procurement, manufacturing to sales, distribution and financial accounting. Provides access to a seamless and safe transaction procedure. Pre-built apps and build custom reports that comply with statutory and regulatory norms. Monitor formulae in real-time to account for input variability and reduce control cost. -
45
3E
3E
The only full-service solution. All the chemical information your workers need to operate safely and sustainably. Simply send us a list of products and let us take care of the rest. We provide the only solution that supports unlimited users and facilities accessing SDSs, documents & data in any global location and in over 128 supported languages. We will match your product list to the most current SDS, acquire SDSs directly from the manufacturer, and index critical data from each SDS for use, including GHS classification and labeling information. Our world-renowned EHS call center is always available to help with any issue, from simple SDS requests to emergency response guidance or assistance with chemical spills, poison exposures, and other natural disasters. Effectively and efficiently inform employees and downstream customers of potential chemical hazards and appropriate protective measures. -
46
Chemwatch
Chemwatch
Chemwatch is a global leader in chemical safety and management solutions, offering a comprehensive suite of software and services designed to streamline chemical management processes. Their platform provides access to the world's largest database of over 140 million Safety Data Sheets (SDS), ensuring up-to-date information for compliance and safety. Key features include SDS management, chemical registers and manifests, risk assessments, labeling, and reporting. Chemwatch's software packages, such as BackPack, GoldFFX, and Chemeritus, cater to various organizational needs, from small businesses to large enterprises, and are available in 49 languages. The platform also integrates with RFID asset management solutions, enabling efficient tracking of chemical and non-chemical assets throughout their lifecycle. With over 30 years of experience, Chemwatch serves more than 5,000 organizations worldwide, including 20 of the top 50 Fortune 500 companies. -
47
NMR Predictors
ACD/Labs
Predict 1D and 2D NMR spectra from structures. From experimental design to data interpretation, NMR predictors can significantly speed up your workflow. Use this software to: - Predict a complete set of 1D and 2D NMR spectra, for 1H, 13C, 15N, 19F, and 31P nuclei from a chemical structure - Calculate chemical shifts and coupling constants in seconds - Train the algorithms with in-house data to improve accuracy for novel chemical space -
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LiveDesign
Schrödinger
LiveDesign is an enterprise informatics platform that enables teams to rapidly advance drug discovery projects by collaborating, designing, experimenting, analyzing, tracking, and reporting in a centralized platform. Capture ideas alongside experimental and modeling data. Create and store new virtual compounds in a centralized database, evaluate through advanced models, and prioritize new designs. Integrate biological data and model results across federated corporate databases, apply sophisticated cheminformatics to analyze all data at once, and progress compounds faster. Drive predictions and designs using advanced physics-based methods paired with machine learning techniques to rapidly improve prediction accuracy. Work together with remote team members in real-time. Share ideas, test, revise, and advance chemical series without losing track of your work. -
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ACD/Name
ACD/Labs
Generate chemical names for structures and produce structures from names according to IUPAC rules. Easily handles challenging areas of nomenclature, and translates chemical names into over 20 languages. -
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IPA can also be used for analysis of small-scale experiments that generate gene and chemical lists. IPA allows searches for targeted information on genes, proteins, chemicals, and drugs, and building of interactive models of experimental systems. Data analysis and search capabilities help in understanding the significance of data, specific targets, or candidate biomarkers in the context of larger biological or chemical systems. The software is backed by the Ingenuity Knowledge Base of highly structured, detail-rich biological and chemical findings. Learn more about QIAGEN Ingenuity Pathway Analysis (IPA). Comparison Analysis determines the most significant pathways, upstream regulators, diseases, biological functions, and more, across time points, dose, or other conditions.
