PDB ligand accession: 7IP
DrugBank: DB07245
PubChem:
ChEMBL:
InChI Key: AEVBKBAFFJKFJZ-UHFFFAOYSA-N
SMILES: COc1cccc(c1)c2cccc(c2)CCc3cccc(n3)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Biphenyls and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2OHQ | Download | Experimental | e2ohqA2 e2ohqA3 | cradle loop barrel cradle loop barrel | LigPlot |