PDB ligand accession: 5ST
DrugBank: n/a
PubChem: n/a
ChEMBL:
InChI Key: YAJFVXIHHOXQOV-MYIHVTGJSA-N
SMILES: COC(=O)Nc1ccc(cc1)c2ccnc(c2)C(Cc3ccccc3)NC(=O)C4CCC(CC4)CN
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyridines and derivatives
- Subclass: Phenylpyridines
- Class: Pyridines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5EXM | Download | Experimental | e5exmA1 | cradle loop barrel | LigPlot |