PDB ligand accession: G54
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: PTCVBQDKOCSZKC-KRWDZBQOSA-N
SMILES: CC1(CCc2c1cc(cc2)c3c4cc[nH]c4ncn3)NC#N
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Indanes
- Subclass: None
- Class: Indanes
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
6DB3 | Download | Experimental | e6db3A1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |