PDB ligand accession: 639
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: KPKGAKOSWKZAAI-UHFFFAOYSA-N
SMILES: Cc1cc2cc(ccc2c(c1Nc3ncnc(n3)Nc4ccc(cc4)C#N)C)C#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Naphthalenes
- Subclass: None
- Class: Naphthalenes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5C25 | Download | Experimental | e5c25B1 e5c25A1 e5c25A3 | Alpha-beta plaits Alpha-beta plaits Ribonuclease H-like | LigPlot |