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MPO-IN-28 - 98%, high purity , CAS No.37836-90-1, Inhibitor of myeloperoxidase
Basic Description Specifications & Purity Moligand™, ≥98% Biochemical and Physiological Mechanisms MPO-IN-28 (Compound 28) is an inhibitor of myeloperoxidase (MPO) with IC50 of 44 nM. Storage Temp Store at -20°C Shipped In Ice chest + Ice pads Grade Moligand™ Action Type INHIBITOR Mechanism of action Inhibitor of myeloperoxidase Product Description Information
MPO-IN-28 MPO-IN-28 (Compound 28) is an inhibitor of myeloperoxidase (MPO) with IC50 of 44 nM.
Targets
MPO (Cell-free assay) 44 nM
Product Properties ALogP 1.14 HBD Count 2 Rotatable Bond 2
Associated Targets(Human) Associated Targets(non-human) Mechanisms of Action Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References
Names and Identifiers IUPAC Name 2-(7-methoxy-4-methylquinazolin-2-yl)guanidine INCHI InChI=1S/C11H13N5O/c1-6-8-4-3-7(17-2)5-9(8)15-11(14-6)16-10(12)13/h3-5H,1-2H3,(H4,12,13,14,15,16) InChi Key ZJBMSSBTCGJZEE-UHFFFAOYSA-N Canonical SMILES CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OC Isomeric SMILES CC1=C2C=CC(=CC2=NC(=N1)N=C(N)N)OC PubChem CID 2835211 MeSH Entry Terms 2-(7-methoxy-4-methylquinazolin-2-yl)guanidine Molecular Weight 231.25
Chemical and Physical Properties Solubility Solubility (25°C) In vitro DMSO: 46 mg/mL (198.91 mM); Water: Insoluble; Ethanol: Insoluble; DMSO(mg / mL) Max Solubility 46 DMSO(mM) Max Solubility 198.918918918919 Water(mg / mL) Max Solubility ＜1
References 1. Soubhye J, Chikh Alard I, Aldib I, Prévost M, Gelbcke M, De Carvalho A, Furtmüller PG, Obinger C, Flemmig J, Tadrent S et al. . (2017) Discovery of Novel Potent Reversible and Irreversible Myeloperoxidase Inhibitors Using Virtual Screening Procedure.. J Med Chem, 60 (15): (6563-6586). [PMID:28671460 ]
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J2214624