PDB ligand accession: 37V
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: XHXQDRCYBSVXOU-UHFFFAOYSA-N
SMILES: c1ccc2c(c1)nc(s2)CNC(=O)c3ccc(cc3OCC(=O)O)F
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenoxyacetic acid derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4QR6 | Download | Experimental | e4qr6A1 | TIM beta/alpha-barrel | LigPlot |