PDB ligand accession: T5Z
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: QVVVMZSMTQUOMU-UHFFFAOYSA-N
SMILES: CC(C)(C(=O)NCCS)Oc1ccc(c(c1)OC)Br
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: Anisoles
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7BAA | Download | Experimental | e7baaA1 | Repetitive alpha hairpins | LigPlot |