PDB ligand accession: 239
DrugBank: DB02398
PubChem:
ChEMBL:
InChI Key: NLBDETRVUYOIHQ-UHFFFAOYSA-N
SMILES: [H]N=C(c1ccc2cc(ccc2c1)C(=O)Nc3ccc(cc3)CN)N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: Naphthalenecarboxylic acids and derivatives
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4FUC | Download | Experimental | e4fucA2 | cradle loop barrel | LigPlot |
1OWH | Download | Experimental | e1owhA1 | cradle loop barrel | LigPlot |