PDB ligand accession: M51
DrugBank: DB11950
PubChem:
ChEMBL:
InChI Key: WGRQANOPCQRCME-PMACEKPBSA-N
SMILES: Cc1cc(n(n1)c2ccccc2)N3CCN(CC3)C4CC(NC4)C(=O)N5CCSC5
Drug action: modulator
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic acids and derivatives
- Class: Carboxylic acids and derivatives
- Subclass: Amino acids, peptides, and analogues
- Class: Carboxylic acids and derivatives
- Superclass: Organic acids and derivatives
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3VJK | Download | Experimental | e3vjkA1 e3vjkA2 e3vjkB1 e3vjkB2 | beta-propeller-like alpha/beta-Hydrolases beta-propeller-like alpha/beta-Hydrolases | LigPlot |