Attributes
UniProt ID
Protein Name
Beta-secretase 1
Ligand Name
(2S)-2-AMINO-2-BENZYL-3-HYDROXYPROPYL 3-({[(1R)-1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)-5-[METHYL(METHYLSULFONYL)AMINO]BENZOATE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JVYHUOIVVLDSHT-GDJIYFAZSA-N
SMILES
CC(c1ccc(cc1)F)NC(=O)c2cc(cc(c2)N(C)S(=O)(=O)C)C(=O)OCC(Cc3ccccc3)(CO)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 2IS0
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Color Legend
Unassigned regionsLigand / hetero atomse2is0A2e2is0A3