Name: 6-O-desmethyl Donepezil
Rating: 5 (10 reviews)

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HIT ID:HIT212719883
Cas No:120013-56-1
常用名:6-O-desmethyl Donepezil
IUPAC:2-[(1-benzylpiperidin-4-yl)methyl]-6-hydroxy-5-methoxy-2,3-dihydro-1H-inden-1-one
IUPAC:2-[(1-benzylpiperidin-4-yl)methyl]-6-hydroxy-5-methoxy-2,3-dihydro-1H-inden-1-one
InChI key:DJRBBQJREIMIEU-UHFFFAOYSA-N

分子式:C23H27NO3
分子量:365.473
氢键供体数 (HBD):1
氢键受体数 (HBA):4
LogP:3.7470021
SMILES:COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1O
SMILES:COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1O

6-O-desmethyl Donepezil is an active metabolite of the acetylcholinesterase inhibitor donepezil . It is formed through dealkylation by the cytochrome P450 (CYP) isoform CYP2D6. It inhibits human ether a go-go (hERG) channels (IC50 = 1.5 μM in HEK293 cells expressing hERG).

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