Ligand name: (2S)-7-tert-butyl-6-chloro-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
PDB ligand accession: 416
DrugBank: n/a
PubChem: 9858913
ChEMBL: CHEMBL1230209
InChI Key: QGCKNIAMHUUUDI-LBPRGKRZSA-N
SMILES: CC(C)(C)c1cc2c(cc1Cl)C=C(C(O2)C(F)(F)F)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzopyrans
      • Subclass: 1-benzopyrans

List of PDB structures and/or AlphaFold models with target protein Q05769

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3MQE	Download	Experimental	e3mqeA1 e3mqeB1 e3mqeC1 e3mqeD1	Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases Heme-dependent peroxidases	LigPlot