PDB ligand accession: BWP
DrugBank: DB07501
PubChem:
ChEMBL: n/a
InChI Key: MEIJADBULOETOV-KRWDZBQOSA-N
SMILES: CN(C)CC(COc1ccc(cc1)Nc2ncc(c(n2)Nc3ccccc3)Br)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Phenol ethers
- Subclass: None
- Class: Phenol ethers
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
1H08 | Download | Experimental | e1h08A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |