Download Database


Format Description MD5 checksum
SANCDB smiles Single SMILES file. Format: SMILES Name ID 39cd1bd78b472254ad1c2143250f98f0 Download
SANCDB SDF Single SDF file 97c9bb6b5765169d9f406d4868602bda Download
Mol2 Zip file containing one file per compound 7531fe34ce309db9f49f92de37920f72 Download
PDB Zip file containing one file per compound 0a88105ca647725b6961b6b58d15a4ba Download
PDBQT Zip file containing one file per compound 0f19b9214b53e015a047a170a82ea9b8 Download
SDF Zip file containing one file per compound 8b7f0f0d81aaaacc406c72b267a6d28c Download
SMILES Zip file containing one file per compound 8f0e44d53775dd2ded9fa27bf2459953 Download
Maestro Zip file containing one file per compound 44a7ce42822970dc1cc39bb754ae40fa Download