PDB ligand accession: 3Q0
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RIXHCYHQTKRWDU-UHFFFAOYSA-N
SMILES: CCNc1cc(nc(n1)N)c2ccc3c(c2)n[nH]c3N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrazoles
- Subclass: Indazoles
- Class: Benzopyrazoles
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3QCQ | Download | Experimental | e3qcqA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |