PDB ligand accession: A0T
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XCFLWTZSJYBCPF-UHFFFAOYSA-N
SMILES: CCNc1c(cnc(n1)Nc2cc(c(cc2OC)C(=O)N3CCOCC3)F)C(F)(F)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 |
---|---|---|---|---|---|
5OP4 | Download | Experimental | e5op4A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |