cloud

cpLogD

A model to predict water-octanol distribution coefficient (logD) for chemical compounds which is a proxy for the lipophilicity which is a major determinant of drug properties and overall suitability of drug candidates.

Documentation

VHP4Safety Documentation

• Service Introduction: Predicting Water–Octanol Distribution Coefficient (logD) for Chemical Compounds

• Workflow: To be added

• Demo: To be added

VHP4Safety Service Metadata

• Stage: https://vhp4safety.github.io/glossary#VHP0000149

• Sub-Stage: https://vhp4safety.github.io/glossary#VHP0000148

• Development Cloud: https://cplogd.cloud.vhp4safety.nl/

• Login Required: Not available

• TRL: Not available

• Type: external

• Contact: Ola Spjuth ()

• API Type: Not available

• Categories: To be added

• Targeted Users: To be added

• Relevant VHP4Safety Use Case: To be added

Techincal Tool Specifications

• Provider: ArosBio

• Citation: 10.1186/s13321-018-0271-1

• Version: 2.0.0

• License: Copyrighted by Aros Bio

• Source Code: https://github.com/pharmbio/cplogd-v2.0

• Docker: https://github.com/pharmbio/cplogd-v2.0/pkgs/container/cplogd-v2.0

• Bio.tools: Not available

• FAIRsharing: Not available

• TeSS: Not available

• RSD: Not available

• Wikipedia: Not available