SmilesDB

A SMILES-first molecular database API

Docs • Explore • Github

A database defined by SMILES strings

SmilesDB is a SMILES-first database. All molecules are stored as SMILES strings, and data is then extracted from that SMILES string.

An accessible, free, open-source API

Available on Github and with a free API endpoint. Comprehensively documentated and platform agnostic.

Over 5,000 molecules, collected and processed.

Accelerating access to thousands of molecules for research and testing. Collected from BindingDB and ChemBL, processed with RDKit.