PDB ligand accession: MFX
DrugBank: DB00218
PubChem: 152946;40467042;
ChEMBL:
InChI Key: FABPRXSRWADJSP-MEDUHNTESA-N
SMILES: COc1c2c(cc(c1N3CC4CCCNC4C3)F)C(=O)C(=CN2C5CC5)C(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Quinoline carboxylic acids
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5CDQ | Download | Experimental | e5cdqA1 e5cdqC1 e5cdqB1 e5cdqR3 e5cdqT2 e5cdqS1 | HTH HTH HAD domain-related HTH HTH HAD domain-related | LigPlot |