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NodeNode / Manipulator

Tautomers

ChemAxon / Infocom JChem Calculator Plugins Isomers Streamable
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Tautomers are organic compounds that are interconvertible by tautomerization. Tautomerization results in the formal migration of a hydrogen atom or proton, accompanied by a switch of a single bond and an adjacent double bond. Usually the catalysts of these reactions are acids or bases. In solution there is an equilibrium state between the tautomeric forms. Some types of tautomers: ketone-enol, amid-imidic acid, lactam-lactim, enamine-imine tautomeric forms. The Tautomer Generation Plugin is able to calculate tautomers based on many user-defined options.

Node details

Input ports
  1. Type: Table
    Data Input
    Input table that contains structure in Structure(Mrv, Sdf, Smiles, etc.) format.
Output ports
  1. Type: Table
    Data Output
    Output table that contains tautomer structure.

Extension

The Tautomers node is part of this extension:

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