PDB ligand accession: Q74
DrugBank: DB08449
PubChem:
ChEMBL:
InChI Key: IEVFQDJUDLCOQY-UHFFFAOYSA-N
SMILES: c1cc2c(cn(c2nc1)CC(=O)O)Cc3nc4c(c(cc(c4s3)F)F)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3G5E | Download | Experimental | e3g5eA1 | TIM beta/alpha-barrel | LigPlot |