PDB ligand accession: E0S
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: JDIHMNISRGRMDY-UHFFFAOYSA-N
SMILES: CC(C)c1ccc2c(c1)C(=O)c3cc(c(nc3O2)N)C(=O)Nc4[nH]nnn4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6BOE | Download | Experimental | e6boeA2 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |