PDB ligand accession: A06
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: MOXSMEYUODNXTB-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(Cc2[nH]c3ccc(cc3n2)Cl)CC(=O)O)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Phenylpropanoids and polyketides
- Class: Phenylpropanoic acids
- Subclass: None
- Class: Phenylpropanoic acids
- Superclass: Phenylpropanoids and polyketides
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4A06 | Download | Experimental | e4a06A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |