PDB ligand accession: 6ED
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QVELLOOBNULIGQ-UHFFFAOYSA-N
SMILES: c1cc2c(cc1F)c(nn2CCN3CCC(CC3)(F)F)Nc4cnccc4C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5IVJ | Download | Experimental | e5ivjA1 | jelly-roll | LigPlot |