PDB ligand accession: G9L
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: CTOQXIXQHAILCA-UHFFFAOYSA-N
SMILES: c1cc2c(cc1F)C(=O)NC3=C2CN(CC3)C(=O)CCN4CCCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: Isoquinolones and derivatives
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
3KI6 | Download | Experimental | e3ki6A1 | ADP-ribosylation | LigPlot |