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What is alvaMolecule?

alvaMolecule is a no-code cheminformatics platform that enables users to visualize, curate, and standardize molecular datasets in preparation for analytical work. It supports widely-used molecular formats like SMILES and SDF/MOL2, allowing seamless navigation through collections in either grid or spreadsheet views while automatically importing pertinent data. The platform guarantees structure verification and standardization through built-in standardizers and customizable SMIRKS rules, aids in the detection and management of duplicates, and offers scaffold analysis to summarize essential frameworks. Moreover, it includes integrated filtering and charting features that enable sorting by substructures, calculated molecular descriptors, and various physicochemical properties. alvaMolecule can calculate approximately 88 structural and physicochemical properties, which include drug-like and lead-like scoring metrics such as LogP, TPSA, and the Lipinski alert index, ultimately supporting users in creating high-quality datasets for QSAR/QSPR modeling, descriptor computations, and virtual screening tasks. In addition, its intuitive interface makes it accessible for researchers of all coding skill levels, allowing them to effectively enhance their cheminformatics endeavors and streamline their research processes.

What is ADME Suite?

Forecasting the absorption, distribution, metabolism, and excretion (ADME) characteristics based on chemical structure is crucial. This set of precise calculations pertaining to pharmacokinetic properties is beneficial for facilitating high-throughput screening of various libraries. Additionally, it offers valuable insights into pharmacological impacts, aiding in the assurance of human safety for the products being developed. Such predictive modeling can significantly enhance the efficiency of drug discovery processes.

Media

Media

Integrations Supported

Additional information not provided

Integrations Supported

Additional information not provided

API Availability

API Availability

Pricing Information

Pricing not provided
Free Version
Free Trial Offered?

Pricing Information

Pricing not provided

Supported Platforms

Windows
Mac
Linux

Supported Platforms

Windows

Customer Service / Support

Web-Based Support

Customer Service / Support

Not specified

Training Options

Documentation Hub
Webinars

Training Options

Not specified

Company Facts

Organization Name

Alvascience

Date Founded

2018

Company Location

Italy

Company Website

www.alvascience.com

Company Facts

Organization Name

ACD/Labs

Date Founded

1994

Company Location

Canada

Company Website

www.acdlabs.com/products/percepta-platform/adme-suite/

Categories and Features

Drug Discovery

Not specified

Categories and Features

Drug Discovery

Not specified

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