PDB ligand accession: I5S
DrugBank: DB07947
PubChem:
ChEMBL:
InChI Key: AUHWQSZMVMMRLM-UHFFFAOYSA-N
SMILES: c1cc2cnccc2c(c1)S(=O)(=O)NCCNCCOCc3ccc(cc3)Cl
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Isoquinolines and derivatives
- Subclass: None
- Class: Isoquinolines and derivatives
- Superclass: Organoheterocyclic compounds
# | DrugDomain Data | UniProt Accession | Drug Action | Affinity data |
---|---|---|---|---|
1 | P00517_I5S | P00517 | n/a | IC50(nM) = 170.0 |
2 | P49841_I5S | P49841 | n/a | |
3 | P17612_I5S | P17612 | n/a | |
4 | P31751_I5S | P31751 | n/a | IC50(nM) = 230.0 |