PDB ligand accession: MUV
DrugBank: DB08223
PubChem:
ChEMBL:
InChI Key: IKOPFHKAECNGQI-VQTJNVASSA-N
SMILES: CNC(=O)CCC(=O)NC(Cc1ccccc1)C(CN(CC2CC2)S(=O)(=O)c3ccco3)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylbutylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2PSV | Download | Experimental | e2psvA1 e2psvB1 | cradle loop barrel cradle loop barrel | LigPlot |