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MeIm

CAT: 0931-T200057-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T200057-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2043947-71-1
Target
LDLR
Related Pathways
Metabolism
Bioactivity
MeIm (compound 7), a peptide mimetic targeting PCSK9, exhibits cholesterol-lowering properties by enhancing the cellular uptake of LDL (EC 50 = 6.04 μM) and obstructing PCSK9's interaction with LDLR (IC 50 = 11.2 μM) . This compound is useful for research in cardiovascular diseases.
Smiles
N=1C=C(C2=NC=C(C3=NC=C(C4=NC=C(C=5C=CC=CC5)N4C)N3C)N2C)N(C1)C
Molecular Formula
C22H22N8
Molecular Weight
398.46
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-Methyl-2-[3-methyl-2-(3-methylimidazol-4-yl)imidazol-4-yl]-5-(1-methyl-5-phenylimidazol-2-yl)imidazole
CAS Number2043947-71-1
PubChem CID145969348
IUPAC Name1-methyl-2-[3-methyl-2-(3-methylimidazol-4-yl)imidazol-4-yl]-5-(1-methyl-5-phenylimidazol-2-yl)imidazole
Molecular FormulaC22H22N8
Molecular Weight398.5
XLogP1
Topological Polar Surface Area71.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity583
SMILES
CN1C=NC=C1C2=NC=C(N2C)C3=NC=C(N3C)C4=NC=C(N4C)C5=CC=CC=C5
InChI
InChI=1S/C22H22N8/c1-27-14-23-10-17(27)20-25-12-19(29(20)3)22-26-13-18(30(22)4)21-24-11-16(28(21)2)15-8-6-5-7-9-15/h5-14H,1-4H3
InChIKey
JYKZQFAVSJPBQM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-Methyl-2-[3-methyl-2-(3-methylimidazol-4-yl)imidazol-4-yl]-5-(1-methyl-5-phenylimidazol-2-yl)imidazole
CAS: 2043947-71-1
CID: 145969348
Formula: C22H22N8
MW: 398.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight398.5
XLogP31
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass398.19674274
Monoisotopic Mass398.19674274
Topological Polar Surface Area71.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity583
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

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