PDB ligand accession: 5RZ
DrugBank: n/a
PubChem: 118988417;135567100;
ChEMBL:
InChI Key: NIDWVLLSHNTXJV-UHFFFAOYSA-N
SMILES: c1cc(ccc1C(=O)CSc2[nH]c3c(n2)C(=O)NC(=N3)N)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5ETP | Download | Experimental | e5etpA1 | Alpha-beta plaits | LigPlot |