Ligand name: N-[(1S)-2-methyl-1-(pyridin-4-ylcarbamoyl)propyl]cyclohexanecarboxamide
PDB ligand accession: CII
DrugBank: DB07560
PubChem: 25134246
ChEMBL: n/a
InChI Key: VYLDPSVXLWTIAJ-HNNXBMFYSA-N
SMILES: CC(C)C(C(=O)Nc1ccncc1)NC(=O)C2CCCCC2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of PDB structures and/or AlphaFold models with target protein P0A512

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2W0A	Download	Experimental	e2w0aA1	Cytochrome P450	LigPlot