Chemaxon blog

28 04 2023
2 minutes

Local and Global Models For Predicting Properties of Small Molecules

Which type of model has the most potential for success? The obvious answer is all models that are...

27 04 2023
3 minutes

How do predicted pKa and solubility values compare to reality?

Discover why Chemaxon's predictions are well accepted and widely used both in industry settings and...

24 04 2023
2 minutes

Cloud calculation exemplified

Augmenting chemical structures with calculated properties using dedicated, secure and scalable...

22 04 2023
< 1 minute

Calculations you can trust

Chemaxon AWS Calculators and Predictors SaaS services has passed one of Hungary’s leading...

20 04 2023
< 1 minute

Solubility prediction - Chemaxon's Solubility Predictor

Aqueous solubility for organic compounds is one of the most important physico-chemical properties...

19 04 2023
< 1 minute

Predicting pKa

One of the most important physicochemical properties of small molecules and macromolecules are the...

03 04 2023
< 1 minute

Compliance screen of 45M compounds in a weekend

Handling large collections of molecules? You need robust cheminformatics tools to identify...

30 03 2023
2 minutes

What Structures are Claimed in Patents? - Use cases for patent literature MMP transformations

The MMP transformations from SureCHEMBL can be used in different ways to create analogues to a seed...

14 11 2022
< 1 minute

Kanban in Drug Discovery

A multi-dimensional, searchable, and interactive Kanban board can help the project team to get a...

11 11 2022
< 1 minute

Responding to the Challenge Posed by the Generic Control of Substances

Read how novel homology groups and state-of-the-art Markush search technologies address these...

03 10 2022
2 minutes

Calculate on the cloud

In order to increase the flexibility, access and integrability, Calculators and Predictors have...

15 08 2022
11 minutes

Stereochemistry in Compound Registration

Table of contents Flat bonds OR structure wedge types OR structure replicates Multiple OR labels...