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Name to structure You do not have to draw a structure! You can generate a structure by giving a name (IUPAC, synonym), CAS #, AKosNumber, InChI, etc.
Compare structures What is the right structure? With a structure on the screen or a name, CAS #, etc. in the text box you will get a grid comparing the structures as they look in different databases. Great to find errors.
Compare activities What is the major activity of a compound? With a structure on the screen or a name, CAS #, etc. in the text box you will get a grid comparing the pharmacological activities as reported in different databases.
Predict chemical properties What is the correct melting point? With a structure on the screen or a name, CAS #, etc. in the text box you will get a grid with GUSAR   calculated physical properties and the links to calculated properties by ACD Labs, and EPI Suite.
Predict biological activities Which are the possible biological effects of a compound? With a structure on the screen you will get a reliable PASS prediction of effects, like toxicities, biological activities, etc.
Chemicalize What is the  IUPAC name, or the logP, etc. With a structure on the screen you will get a lot of calculated data.
soon to come Search peptides! This is a unique application to search structure-modified peptides You can analyze the results very easily. You can also ask for all peptides that are „anti-inflammatory“.

 

 

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