PDB ligand accession: 3EH
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: WVYHFPSGWCCXMO-UHFFFAOYSA-N
SMILES: CCN(CC)CCCOC(=O)Nc1cccc(c1)CN2C(=O)SCC(=N2)c3ccc(c(c3)OC)OC
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylcarbamic acid esters
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4R1Y | Download | Experimental | e4r1yA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |