PDB ligand accession: 1B4
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WWUBOSRORWJGRU-UHFFFAOYSA-N
SMILES: CC(C)NC(=O)c1c[nH]c2c1nc(cn2)c3cc(c(c(c3)OC)OC)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Pyrrolopyrazines
- Subclass: None
- Class: Pyrrolopyrazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4I0R | Download | Experimental | e4i0rA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |