PDB ligand accession: 740
DrugBank: DB07220
PubChem:
ChEMBL:
InChI Key: ZXYIRNXOAJYLCU-UHFFFAOYSA-N
SMILES: c1cc(ccc1CC(=O)Nc2c3cc(ccc3[nH]n2)N4CCCS4(=O)=O)N5CCCCC5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Piperidines
- Subclass: Phenylpiperidines
- Class: Piperidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2R64 | Download | Experimental | e2r64A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |