PDB ligand accession: 1M4
DrugBank: n/a
PubChem:
ChEMBL: n/a
InChI Key: GCJNGEZDKLVQNN-CQSZACIVSA-N
SMILES: CC1(CC2(c3cc(ccc3O1)Br)C(=O)N(C(=N2)N)C)C
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organoheterocyclic compounds
- Class: Benzopyrans
- Subclass: 1-benzopyrans
- Class: Benzopyrans
- Superclass: Organoheterocyclic compounds
| # | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
|---|---|---|---|---|---|
| 1 | P56817_1M4 | P56817 | Beta-secretase 1 (EC | n/a |