Ligand name: 4-(DIMETHYLAMINO)-N-{[(2R)-1-ETHYLPYRROLIDIN-2-YL]METHYL}-2-METHOXY-5-NITROBENZAMIDE
PDB ligand accession: C56
DrugBank: n/a
PubChem: 7390465
ChEMBL: n/a
InChI Key: AFNPLUMDSLEAPD-GFCCVEGCSA-N
SMILES: CCN1CCCC1CNC(=O)c2cc(c(cc2OC)N(C)C)[N+](=O)[O-]
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Nitrobenzenes

List of PDB structures and/or AlphaFold models with target protein P21836

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4ARA	Download	Experimental	e4araA1 e4araB1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot
4A23	Download	Experimental	e4a23A1 e4a23B1	alpha/beta-Hydrolases alpha/beta-Hydrolases	LigPlot