ChemAIRS^® is the industry-leading AI-powered retrosynthesis platform, providing chemists with rapid, diverse, and practical synthesis routes. It considers every angle of chemical synthesis in ways no other CASP does, from impurity prediction to process chemistry.

Inside ChemAIRS

Explore Retrosynthetic Pathways Faster

Why be bound by the limits of one brain’s intuition? ChemAIRS expands your reach, analyzing thousands of retrosynthetic pathways in minutes to give you the most feasible, and diverse pathways.

Retrosynthesis

Scale-Up Smarter
and Faster

Scaling up a reaction requires more than just increasing quantities—it demands efficiency and cost-effective pathways. ChemAIRS delivers diverse synthetic strategies, identifies bulk-sourcable building blocks, and optimizes conditions for large-scale production.

Process Chemistry

Validate Synthesizability Early with SA Score

Not every molecule designed virtually is practical to synthesize. Our proprietary synthesizability assessment SA Score assesses feasibility upfront, ensuring that virtual designs translate into lab-ready synthesis plans.

Synthesizability

More Capabilities

Predict Impurities Before They Impact Your Results

Unexpected byproducts can be costly and disrupt synthesis. With our exclusive AI-driven impurity prediction, you can identify potential side products with over 90% accuracy.

impurity prediction
Condition Optimization: Precise, Reliable, Risk-Aware

ChemAIRS balances feasibility and risk by recommending optimal conditions, identifying potential side reactions, and integrating ELN data for customized searches.

Condition Optimization
Expand Research Possibilities with Forward Synthesis

Struggling to find novel, synthesizable structures in vast chemical data? ChemAIRS generates tailored molecular libraries for your target while identifying pathways that are both innovative and feasible.

Forward Synthesis
Keep Proprietary Research Secure

Not all AI platforms prioritize security, but ChemAIRS does. With local deployment and seamless ELN integration, your proprietary data remains fully under your control, never stored, never shared.
Make Smarter Cost Decisions with Real-Time Pricing

Does sourcing starting materials complicate your synthesis strategies? Real-time market pricing provides a clearer picture of material availability, allowing you to make data-driven decisions.