Name: PF-04449613
Rating: 5 (10 reviews)

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sdf 文件

结构编辑

类似物检索

HIT ID:HIT214321857
Cas No:1236858-52-8
常用名:PF-04449613
IUPAC:1-(oxan-4-yl)-6-[(1R)-1-(3-phenoxyazetidin-1-yl)ethyl]-1H,4H,7H-pyrazolo[3,4-d]pyrimidin-4-one
IUPAC:1-(oxan-4-yl)-6-[(1R)-1-(3-phenoxyazetidin-1-yl)ethyl]-1H,4H,7H-pyrazolo[3,4-d]pyrimidin-4-one
InChI key:FHBANDDJQJAZOQ-CQSZACIVSA-N

分子式:C21H25N5O3
分子量:395.463
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:C[C@@H](N1CC(C1)Oc1ccccc1)c1nc(=O)c2cnn(C3CCOCC3)c2[nH]1
SMILES:C[C@@H](N1CC(C1)Oc1ccccc1)c1nc(=O)c2cnn(C3CCOCC3)c2[nH]1

PF-04449613 is a phosphodiesterase 9A (PDE9A) inhibitor (IC50= 22 nM).1It is selective for PDE9A over PDE1C (IC50= >1,000 nM), as well as over a variety of other PDEs, inhibiting PDE2-8, -10, and -11 activity by less than 30% in a panel of enzymes, ion channels, and transporters at 1 μM but does inhibit the human dopamine transporter (DAT; Ki= 293 nM).

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