PDB ligand accession: 4B7
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QUFCHHSHOLSVOT-UHFFFAOYSA-N
SMILES: Cc1nc(cc(n1)N2CCN(CC2)CCO)Nc3ncc(s3)C(=O)Nc4ccc(cc4)Oc5ccccc5
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Anilides
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YBK | Download | Experimental | e4ybkA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |