Ligand name: 2-(ethylsulfanyl)-N-methyl-N-[(1-phenyl-1H-pyrazol-4-yl)methyl]acetamide
PDB ligand accession: 4GG
DrugBank: n/a
PubChem: 137348238
ChEMBL: n/a
InChI Key: PWEWVWHEVCEXNS-UHFFFAOYSA-N
SMILES: CCSCC(=O)N(C)Cc1cnn(c1)c2ccccc2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

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
4YQV	Download	Experimental	e4yqvA1 e4yqvA2 e4yqvB1 e4yqvB2 e4yqvC1 e4yqvC2	Repetitive alpha hairpins Thioredoxin-like Repetitive alpha hairpins Thioredoxin-like Thioredoxin-like Repetitive alpha hairpins	LigPlot