Ligand name: N-{3-[(2-chloro-acetyl)-(4-nitro-phenyl)-amino]-propyl}-2,2,2-trifluoro-acetamide
PDB ligand accession: MLX
DrugBank: n/a
PubChem: 4257368
ChEMBL: CHEMBL1502738
InChI Key: RPFLJHUKWQKWPO-UHFFFAOYSA-N
SMILES: c1cc(ccc1N(CCCNC(=O)C(F)(F)F)C(=O)CCl)[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 P78417

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5YVO	Download	Experimental	e5yvoA2	Repetitive alpha hairpins	LigPlot
5V3Q	Download	Experimental	e5v3qA1 e5v3qA2	Repetitive alpha hairpins Thioredoxin-like	LigPlot