PDB ligand accession: 7Z5
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: GXDVHWJUYDHZKB-UHFFFAOYSA-N
SMILES: CCC(=O)Nc1ccc(cc1C(=O)O)N(C)Cc2cccnc2
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 |
---|---|---|---|---|---|
3KVL | Download | Experimental | e3kvlA1 | TIM beta/alpha-barrel | LigPlot |