PDB ligand accession: OTJ
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JTVUNKGTKMZKDP-UHFFFAOYSA-N
SMILES: COC(=O)Nc1ccc(cc1)c2c([nH]c(n2)CNC(=O)CCc3cc(ccc3N4C=NNN4)Cl)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Azolines
- Subclass: Tetrazolines
- Class: Azolines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4CRD | Download | Experimental | e4crdA1 | cradle loop barrel | LigPlot |