PDB ligand accession: 1NS
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: BKOWIHMCGFRARN-UHFFFAOYSA-N
SMILES: CS(=O)(=O)NCCC1CCN(CC1)c2c3c(cc(s3)C(=O)N)ncn2
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 |
---|---|---|---|---|---|
4JT9 | Download | Experimental | e4jt9A1 e4jt9A2 | Rossmann-like Rubredoxin-like | LigPlot |