PDB ligand accession: H12
DrugBank: DB07867
PubChem: 448724;5288496;
ChEMBL:
InChI Key: BNZHKKGOSYAQSW-UHFFFAOYSA-N
SMILES: CCCC1=C(c2cc(ccc2NC1=O)Cl)OC3CCCCC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Quinolines and derivatives
- Subclass: Quinolones and derivatives
- Class: Quinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1TKT | Download | Experimental | e1tktA5 e1tktA7 e1tktB2 | Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits | LigPlot |