PDB ligand accession: QW0
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: JWIWXNMAPDVMPI-QHHAFSJGSA-N
SMILES: c1cc2c(cc1c3c(nc([nH]3)CNC(=O)C=Cc4cc(ccc4n5cnnn5)Cl)Cl)[nH]nc2N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Cinnamic acids and derivatives
- Subclass: Cinnamic acid amides
- Class: Cinnamic acids and derivatives
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
8BO6 | Download | Experimental | e8bo6AAA1 | cradle loop barrel | LigPlot |