PDB ligand accession: 5T5
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: AVRZQFKBYKMVDH-SPYBWZPUSA-N
SMILES: c1cc(ccc1C2(COC(=N2)N)C3CC3C(=O)c4cc(cnc4)Cl)OC(F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6DMI | Download | Experimental | e6dmiA1 e6dmiA2 | cradle loop barrel cradle loop barrel | LigPlot |
5EZX | Download | Experimental | e5ezxA1 e5ezxA2 | cradle loop barrel cradle loop barrel | LigPlot |