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1449277-10-4

1449277-10-4 Structure

1449277-10-4 Structure
IdentificationBack Directory
[Name]

GNE-495
[CAS]

1449277-10-4
[Synonyms]

GNE-495
GNE-495;GNE 495;GNE495
8-Amino-N-[1-(cyclopropylcarbonyl)-3-azetidinyl]-2-(3-fluorophenyl)-1,7-naphthyridine-5-carboxamide
8-amino-N-(1-(cyclopropanecarbonyl)azetidin-3-yl)-2-(3-fluorophenyl)-1,7-naphthyridine-5-carboxamide
1,7-Naphthyridine-5-carboxamide, 8-amino-N-[1-(cyclopropylcarbonyl)-3-azetidinyl]-2-(3-fluorophenyl)-
[Molecular Formula]

C22H20FN5O2
[MDL Number]

MFCD30489735
[MOL File]

1449277-10-4.mol
[Molecular Weight]

405.42
Chemical PropertiesBack Directory
[Boiling point ]

734.5±60.0 °C(Predicted)
[density ]

1.45±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO:3.59(Max Conc. mg/mL);8.85(Max Conc. mM)
DMSO:PBS (pH 7.2) (1:7):0.125(Max Conc. mg/mL);0.31(Max Conc. mM)
DMF:5.0(Max Conc. mg/mL);12.33(Max Conc. mM)
Water:1.0(Max Conc. mg/mL);2.47(Max Conc. mM)
[form ]

A crystalline solid
[pka]

11.60±0.20(Predicted)
[color ]

Light yellow to yellow
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Skull and Crossbones (GHS06)
GHS05,GHS06
[Signal word ]

Danger
[Hazard statements ]

H301-H318
[Precautionary statements ]

P280-P301+P310-P330-P305+P351+P338-P310
[HS Code ]

2933998090
Hazard InformationBack Directory
[Uses]

GNE-495 is a potent and selective MAP4K4 inhibitor with an IC50 of 3.7 nM.
[in vivo]

GNE-495 is administered intraperitoneally to neonatal mouse pups at high doses: 25 and 50 mg/kg. GNE-495 shows good in vivo profile in all species tested, with low clearances, moderate terminal half-lives, and reasonable oral exposure levels (F=37-47%)[1].

[IC 50]

MAP4K4: 3.7 nM (IC50)
[References]

[1] Ndubaku CO et al. Structure-Based Design of GNE-495, a Potent and Selective MAP4K4 Inhibitor with Efficacy in Retinal Angiogenesis. ACS Med Chem Lett. 2015 Jun 29;6(8):913-8. DOI:10.1021/acsmedchemlett.5b00174
Spectrum DetailBack Directory
[Spectrum Detail]

GNE-495(1449277-10-4)1HNMR
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