PDB ligand accession: 9FJ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: NXQKMWGCRMQRSS-ZDUSSCGKSA-N
SMILES: COc1ccc2c(c1)CCCC2CNc3cnccc3C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Tetralins
- Subclass: None
- Class: Tetralins
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5VMP | Download | Experimental | e5vmpA1 e5vmpB1 e5vmpC1 e5vmpD1 | jelly-roll jelly-roll jelly-roll jelly-roll | LigPlot |