PDB ligand accession: 7VR
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: TVKWRLSBRIRPDH-HKOYGPOVSA-N
SMILES: CCON=Cc1ccc(cc1)OCCCCCN2CCN(C2=O)c3ccncc3
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 |
---|---|---|---|---|---|
4CDQ | Download | Experimental | e4cdqA1 e4cdqC1 | jelly-roll jelly-roll | LigPlot |