Name: AAK1-IN-5
Rating: 5 (10 reviews)

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HIT ID:HIT214433834
Cas No:1815613-44-5
常用名:AAK1-IN-5
IUPAC:(2S)-1-{[2',4-bis(difluoromethyl)-[2,4'-bipyridin]-5-yl]oxy}-2,4-dimethylpentan-2-amine
IUPAC:(2S)-1-{[2',4-bis(difluoromethyl)-[2,4'-bipyridin]-5-yl]oxy}-2,4-dimethylpentan-2-amine
InChI key:HVHRHDHQHUAOQI-IBGZPJMESA-N

分子式:C19H23F4N3O
分子量:385.407
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:CC(C)C[C@](C)(N)COc1cnc(cc1C(F)F)-c1ccnc(c1)C(F)F
SMILES:CC(C)C[C@](C)(N)COc1cnc(cc1C(F)F)-c1ccnc(c1)C(F)F

AAK1-IN-5 is a potent and specific inhibitor of adaptor protein-2-associated kinase 1 (AAK1), characterized by its ability to penetrate the central nervous system and its oral bioavailability. It displays high selectivity, with an AAK1 inhibitory potency (IC 50) of 1.2 nM, a binding affinity (K i) of 0.05 nM, and an inhibitory potency against cellular AAK1 activity (cell IC 50) of 0.5 nM. AAK1-IN-5 holds promise for investigating neuropathic pain in scientific research [1].

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