Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
~{N},~{N}-dimethyl-2-pyrrolidin-1-yl-quinazolin-4-amine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
VONNLDQOEHSECV-UHFFFAOYSA-N
SMILES
CN(C)c1c2ccccc2nc(n1)N3CCCC3
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
Interactive Mol* view for the current protein-molecule pair.
Structure: 5MXD
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Color Legend
Unassigned regionsLigand / hetero atomse5mxdA1e5mxdA2e5mxdB1e5mxdB2e5mxdC1e5mxdC2
ECOD domains from experimental PDB structures interacting with ligand III