Ligand name: N-[3-(diethylamino)propyl]-2-(12-methyl-9-oxidanylidene-5-thia-1,10,11-triazatricyclo[6.4.0.0^2,6]dodeca-2(6),3,7,11-tetraen-10-yl)ethanamide
PDB ligand accession: 8C3
DrugBank: n/a
PubChem: 16011141
ChEMBL: CHEMBL2141272
InChI Key: DRDIHUMOFDGYRJ-UHFFFAOYSA-N
SMILES: CCN(CC)CCCNC(=O)CN1C(=O)c2cc3c(n2C(=N1)C)ccs3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Thienopyrroles
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q96T88

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5XPI	Download	Experimental	e5xpiA1 e5xpiA2	SH3 SH3	LigPlot