PDB ligand accession: 6G1
DrugBank: n/a
PubChem:
ChEMBL:
InChI Key: RQGSIJUNMAAIRB-UHFFFAOYSA-N
SMILES: c1cc2cnccc2c(c1)S(=O)(=O)N3CCN(CC3)C(=O)C4CCCCC4
Drug action: n/a
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: None
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name | LigPlot |
---|---|---|---|---|---|
5J5R | Download | Experimental | e5j5rA1 | TIM beta/alpha-barrel | LigPlot |