PDB ligand accession: SX2
DrugBank: DB08578
PubChem: 647833;4284847;
ChEMBL:
InChI Key: XFYYQDHEDOXWGA-UHFFFAOYSA-N
SMILES: c1cc(ncc1Br)NC(=O)CCC(=O)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic nitrogen compounds
- Class: Organonitrogen compounds
- Subclass: N-arylamides
- Class: Organonitrogen compounds
- Superclass: Organic nitrogen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6Y8M | Download | Experimental | e6y8mA1 | beta-Trefoil | LigPlot |