Chemical Components in the PDB

pdbe.org/chem
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PDBeChem : Molecule Descriptor

 Molecule : 9KY

Encoding of molecule in descriptor string

Name

SMILES

Program

ACDLabs

Version

12.01

Name

n3c5c(n(C(C(NC1CCCCC1)=O)C2CCCCC2)c3c4ccc(cc4)CO)cccc5