PDB ligand accession: 3WR
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: OWKPAZCWJGPSQU-UHFFFAOYSA-N
SMILES: c1cc(ccc1NC(=O)Nc2cc(ccc2F)C(F)(F)F)N3C=CC(=O)c4c3ncnc4N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: N-phenylureas
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4X3J | Download | Experimental | e4x3jA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |