PDB ligand accession: QQW
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: DMTPPQGUBJBLMN-SPYBWZPUSA-N
SMILES: CC1CN(C(CO1)CCO)C(=O)c2cc3c(c(c2)OC)oc(n3)NC(C)c4cccc(c4)Cl
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzoxazoles
- Subclass: None
- Class: Benzoxazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6ZV7 | Download | Experimental | e6zv7H1 | cradle loop barrel | LigPlot |