Name: LY 2886721 Hydrochloride
Rating: 5 (10 reviews)

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HIT ID:HIT212035910
Cas No:1262036-49-6
常用名:LY 2886721 Hydrochloride
IUPAC:N-{3-[(4aS,7aS)-2-amino-4H,4aH,5H,7H,7aH-furo[3,4-d][1,3]thiazin-7a-yl]-4-fluorophenyl}-5-fluoropyridine-2-carboxamide hydrochloride
IUPAC:N-{3-[(4aS,7aS)-2-amino-4H,4aH,5H,7H,7aH-furo[3,4-d][1,3]thiazin-7a-yl]-4-fluorophenyl}-5-fluoropyridine-2-carboxamide hydrochloride
InChI key:JHHMCINLHBUFHB-GHDSXOKHSA-N

分子式:C18H17ClF2N4O2S
分子量:426.87
氢键供体数 (HBD):2
氢键受体数 (HBA):5
LogP:2.4505944
SMILES:Cl.[H][C@@]12COC[C@@]1(N=C(N)SC2)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |t:7|
SMILES:Cl.[H][C@@]12COC[C@@]1(N=C(N)SC2)c1cc(NC(=O)c2ccc(F)cn2)ccc1F |t:7|

Potent and selective β-secretase (BACE) inhibitor (IC50 values are 10.2 and 20.3 nM for human BACE2 and BACE1, respectively). Displays >5,000-fold selectivity for BACE over other proteases including cathepsin D, pepsin and renin. Inhibits Aβ1-40 and Aβ1-42 production in cells expressing mutated APP. Reduces hippocampal and cortical Aβ and sAPPβ levels in an Alzheimer's disease mouse model.

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