PDB ligand accession: CPF
DrugBank: DB00537
PubChem: 2764;4011971;
ChEMBL:
InChI Key: MYSWGUAQZAJSOK-UHFFFAOYSA-N
SMILES: c1c2c(cc(c1F)N3CCNCC3)N(C=C(C2=O)C(=O)O)C4CC4
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 |
---|---|---|---|---|---|
8GJL | Download | Experimental | e8gjlC3 e8gjlC4 | Alpha-beta plaits Alpha-beta plaits | LigPlot |