PDB ligand accession: VR2
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: SVYVYARVADIYRJ-INIZCTEOSA-N
SMILES: CC(CCN1CCN(C1=O)c2ccncc2)CCOc3ccc(cc3)I
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4CDW | Download | Experimental | e4cdwC1 e4cdwA1 | jelly-roll jelly-roll | LigPlot |