PDB ligand accession: 25Q
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CHHKMVNVTYIPGZ-UHFFFAOYSA-N
SMILES: COc1cccc(c1)n2c(c(c3c2nc4ccccc4n3)C(=O)N)N
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 |
---|---|---|---|---|---|
4P4C | Download | Experimental | e4p4cA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |