Chemical Components in the PDB

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PDBeChem : Molecule Descriptor

 Molecule : QI9

Encoding of molecule in descriptor string

Name

Canonical SMILES

Program

CACTVS

Version

3.385

Name

COc1ccc2nccc([C@@H](O)[C@@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C)c2c1