Ligand name: 6-chloro-N-{(3S)-1-[(2S)-1-{(1R,5S)-7-[2-(methylamino)ethyl]-3,7-diazabicyclo[3.3.1]non-3-yl}-1-oxopropan-2-yl]-2-oxopy rrolidin-3-yl}naphthalene-2-sulfonamide
PDB ligand accession: 44I
DrugBank: n/a
PubChem: 69329219
ChEMBL: n/a
InChI Key: NSTQUPKYMBYQSS-KSYXXAMZSA-N
SMILES: CC(C(=O)N1CC2CC(C1)CN(C2)CCNC)N3CCC(C3=O)NS(=O)(=O)c4ccc5cc(ccc5c4)Cl

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Naphthalenes
      • Subclass: Naphthalene sulfonic acids and derivatives

List of proteins that are targets for 44I

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P00742_44I	P00742	n/a