PDB ligand accession: H52
DrugBank: DB07876
PubChem:
ChEMBL:
InChI Key: AWDORCFLUJZUQS-ZDUSSCGKSA-N
SMILES: Cc1cncc2c1c(ccc2)S(=O)(=O)N3CCCNCC3C
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 |
---|---|---|---|---|---|
4F1T | Download | Experimental | e4f1tA1 | Protein kinase/SAICAR synthase/ATP-grasp | LigPlot |