Ligand name: butyl-[(2~{S})-1-[2-cycloheptylethyl(methyl)azaniumyl]-3-(1~{H}-indol-3-yl)propan-2-yl]-methyl-azanium
PDB ligand accession: HUK
DrugBank: n/a
PubChem: 138753254
ChEMBL: n/a
InChI Key: JNHBUJVXUSKTKS-DEOSSOPVSA-P
SMILES: CCCC[NH+](C)C(Cc1c[nH]c2c1cccc2)C[NH+](C)CCC3CCCCCC3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Indoles and derivatives
      • Subclass: Tryptamines and derivatives

List of PDB structures and/or AlphaFold models with target protein P06276

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6QAE	Download	Experimental	e6qaeA1	alpha/beta-Hydrolases	LigPlot