Name: PDE12-IN-1
Rating: 5 (10 reviews)

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HIT ID:HIT214323277
Cas No:2259620-80-7
常用名:PDE12-IN-1
别名:PDE12-IN-1
IUPAC:3-{5-bromo-6-[(2S,3S)-2-(4-fluorophenyl)-3-(hydroxymethyl)morpholine-4-carbonyl]-1-methyl-1H-1,3-benzodiazol-2-yl}-1-ethyl-1H-indole-6-carbonitrile
IUPAC:3-{5-bromo-6-[(2S,3S)-2-(4-fluorophenyl)-3-(hydroxymethyl)morpholine-4-carbonyl]-1-methyl-1H-1,3-benzodiazol-2-yl}-1-ethyl-1H-indole-6-carbonitrile
InChI key:YWMAQKQMUXYMAZ-VMPREFPWSA-N

分子式:C31H27BrFN5O3
分子量:616.491
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CCn1cc(-c2nc3cc(Br)c(cc3n2C)C(=O)N2CCO[C@H]([C@@H]2CO)c2ccc(F)cc2)c2ccc(cc12)C#N
SMILES:CCn1cc(-c2nc3cc(Br)c(cc3n2C)C(=O)N2CCO[C@H]([C@@H]2CO)c2ccc(F)cc2)c2ccc(cc12)C#N

PDE12-IN-1 is a powerful and specific inhibitor of PDE12, exhibiting a pIC 50 value of 9.1 for enzyme inhibition. It effectively enhances levels of 2′,5′-linked adenylate polymers (2-5A), with a pEC 50 value of 7.7. Additionally, PDE12-IN-1 demonstrates antiviral activity.

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