PDB ligand accession: 4EL
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CBZPCOUPBNLTKW-UHFFFAOYSA-N
SMILES: Cc1nnc(s1)NS(=O)(=O)c2ccc(cc2)NCc3cc(cc(c3)C(=O)O)c4ccc(nc4)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylmethylamines
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4YKN | Download | Experimental | e4yknA3 e4yknA4 | Repetitive alpha hairpins Immunoglobulin-like beta-sandwich | LigPlot |