PDB ligand accession: 1NQ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: IXDTWYVAYLILOL-UHFFFAOYSA-N
SMILES: CCNC(=O)c1ccc(s1)C(=O)NCCC2CCN(CC2)c3c4c(cc(s4)C(=O)N)ncn3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Thienopyrimidines
- Subclass: None
- Class: Thienopyrimidines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
4JSR | Download | Experimental | e4jsrA1 e4jsrA2 | Rossmann-like Rubredoxin-like | LigPlot |