Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
N-{3-[(2R)-6-amino-2,4-dimethyl-3-oxo-2,3,4,5-tetrahydropyrazin-2-yl]phenyl}-5-chloropyridine-2-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
MRYFMHAPTQCQLE-GOSISDBHSA-N
SMILES
CC1(C(=O)N(CC(=N1)N)C)c2cccc(c2)NC(=O)c3ccc(cn3)Cl
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 3U6A
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Color Legend
Unassigned regionsLigand / hetero atomse3u6aA2e3u6aA3e3u6aB2e3u6aB3e3u6aC2e3u6aC3
ECOD domains from experimental PDB structures interacting with ligand 18P