PDB ligand accession: DF1
DrugBank: DB07647
PubChem:
ChEMBL: n/a
InChI Key: VBASHTSSQNDDAS-CQSZACIVSA-N
SMILES: CC(CNc1c2c(c([nH]c2ncn1)c3ccccc3)c4ccccc4)O
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrroles
- Subclass: Substituted pyrroles
- Class: Pyrroles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
2BRN | Download | Experimental | e2brnA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |