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OX04528

CAT: 0957-E1922-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0957-E1922-01Size:5 mg
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Description
OX04528 (compound 68) is a potent and G-protein-biased agonist of G protein-coupled receptor 84 (GPR84) . OX04528 inhibits cAMP production with an EC50 value of 0.00598 nM (5.98 pM), respectively.
CAS Number
3028055-45-7
Synonyms
Compound 68
Target
GPR
Activity
GPCR & G Protein
Molecular Formula
C16H13F6NO2

Chemical Information

CID 170453166
CAS Number3028055-45-7
PubChem CID170453166
IUPAC Name5-[3-[3,5-bis(trifluoromethyl)phenyl]propyl]-1-oxidopyridin-1-ium-3-ol
Molecular FormulaC16H13F6NO2
Molecular Weight365.27
XLogP4
Topological Polar Surface Area45.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity406
SMILES
C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CCCC2=CC(=C[N+](=C2)[O-])O
InChI
InChI=1S/C16H13F6NO2/c17-15(18,19)12-4-10(5-13(7-12)16(20,21)22)2-1-3-11-6-14(24)9-23(25)8-11/h4-9,24H,1-3H2
InChIKey
DPLHUGXFERHOJE-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 170453166
CAS: 3028055-45-7
CID: 170453166
Formula: C16H13F6NO2
MW: 365.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight365.27
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass365.08504763
Monoisotopic Mass365.08504763
Topological Polar Surface Area45.7 Ų
Heavy Atom Count25
Formal Charge0
Complexity406
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
E1922-25mgOX04528

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