PDB ligand accession: 0R4
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WFDHLKUQFQCHKF-UHFFFAOYSA-N
SMILES: CC(=O)Nc1cccc(c1)c2ccc3c(n2)n(c(n3)c4cccnc4N)c5ccc(cc5)CNC(=O)c6cccc(c6)F
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 |
---|---|---|---|---|---|
4EJN | Download | Experimental | e4ejnA3 e4ejnA2 | Protein kinase/SAICAR synthase/ATP-grasp PH domain-like | LigPlot |