Radical Pathway Search

Enter in the reactant and target molecules with reaction conditions below. On submission, trained reaction prediction models will perform a constrained search for the target molecule starting from the reactants. Please note that the maximum runtime for the pathway search is 15 minutes.

Reactants:*

Target molecules (a list of SMILES strings or masses, separated by commas):*

Reaction context

How deep the search tree must be expanded.

How many reactions must be
considered at each level.

Reactions condition.

Minimum score of a reaction to be considered in the pathway expansion.

The type of reactions for each prediction.

Chemistry rules applied to the list of products.