PDB ligand accession: 16V
DrugBank: DB17999
PubChem:
ChEMBL:
InChI Key: WBFUHHBPNXWNCC-UHFFFAOYSA-N
SMILES: Cc1c(c(n[nH]1)C)CCCOc2cc(ccc2F)C(=O)O
Drug action: modulator
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 |
---|---|---|---|---|---|
4HIQ | Download | Experimental | e4hiqA1 e4hiqB1 | Immunoglobulin-like beta-sandwich Immunoglobulin-like beta-sandwich | LigPlot |