PDB ligand accession: 61W
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: FOQRKFCLRMMKAT-UHFFFAOYSA-N
SMILES: CCCN1CCC=C(C1)c2cc(no2)c3ccc(cc3)C
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Toluenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5HK1 | Download | Experimental | e5hk1A2 e5hk1B1 e5hk1C1 | jelly-roll jelly-roll jelly-roll | LigPlot |