PDB ligand accession: T6W
DrugBank: n/a
PubChem: n/a
ChEMBL: n/a
InChI Key: PHBDFVDEJDSKGW-UHFFFAOYSA-O
SMILES: CC(C)(C(=O)NCCS)Oc1ccc(cc1Cl)[N+](=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Nitrobenzenes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
7BAB | Download | Experimental | e7babA1 | Repetitive alpha hairpins | LigPlot |