Name: β-Secretase Inhibitor I
Rating: 5 (10 reviews)

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结构编辑

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HIT ID:HIT214322819
Cas No:1818239-19-8
常用名:β-Secretase Inhibitor I
IUPAC:N-{3-[(4R,5R,6R)-2-amino-5-fluoro-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-4-yl]-4-fluorophenyl}-5-(fluoromethoxy)pyrazine-2-carboxamide
IUPAC:N-{3-[(4R,5R,6R)-2-amino-5-fluoro-4,6-dimethyl-5,6-dihydro-4H-1,3-thiazin-4-yl]-4-fluorophenyl}-5-(fluoromethoxy)pyrazine-2-carboxamide
InChI key:JWJQXZNLFNMIHE-AHRODOEDSA-N

分子式:C18H18F3N5O2S
分子量:425.43
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@H]1SC(N)=N[C@@](C)([C@H]1F)c1cc(NC(=O)c2cnc(OCF)cn2)ccc1F |c:4|
SMILES:C[C@H]1SC(N)=N[C@@](C)([C@H]1F)c1cc(NC(=O)c2cnc(OCF)cn2)ccc1F |c:4|

β-Secretase Inhibitor I is a highly potent inhibitor of the β-secretase enzyme. This compound exhibits exceptional inhibitory activity while also demonstrating a significant reduction in cardiovascular and liver toxicity.

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