Cruzain-IN-1

• CAT Number: I012445
• CAS Number: 1199523-24-4
• Molecular Formula: C14H10F2N6
• Molecular Weight: 300.27
• Purity: ≥95%
• Synonyms: 6-(3,5-difluoroanilino)-9-ethylpurine-2-carbonitrile
• InChI: InChI=1S/C14H10F2N6/c1-2-22-7-18-12-13(20-11(6-17)21-14(12)22)19-10-4-8(15)3-9(16)5-10/h3-5,7H,2H2,1H3,(H,19,20,21)
• InChIKey: SZYYBVWPURUFRR-UHFFFAOYSA-N
• SMILES: CCN1C=NC2=C(N=C(N=C21)C#N)NC3=CC(=CC(=C3)F)F

Cruzain-IN-1 is a covalent and reversible Cruzain inhibitor, with an IC50 of 10 nM.

Reference

[1]. Lee GM, et al. Mapping inhibitor binding modes on an active cysteine protease via nuclear magnetic resonance spectroscopy. Biochemistry. 2012 Dec 18;51(50):10087-98.
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