PDB ligand accession: ME1
DrugBank: DB08173
PubChem:
ChEMBL:
InChI Key: UCKHUNHXYMAFQM-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)NCCNC(=O)c2ccc(s2)Cl)N3C=CC=CC3=O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoic acids and derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2P93 | Download | Experimental | e2p93A1 | cradle loop barrel | LigPlot |