PDB ligand accession: KWZ
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: XGXDWBUGQKHTSH-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C(F)(F)F)c2cc(nc(n2)C#N)CCCN3CCCCC3
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Diazines
- Subclass: Pyrimidines and pyrimidine derivatives
- Class: Diazines
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KWZ | Download | Experimental | e3kwzA1 | Cysteine proteinases-like | LigPlot |