SIMR-2418

SIMR-2418 is an effective inhibitor of the main protease (Mpro) of SARS-CoV-2, with an IC50 value of 20.7 μM. SIMR-2418 can be used for research on SARS-CoV-2 virus infection[1].

Product Specifications

CAS Number

[2694123-92-5]

UNSPSC

12352005

Target

SARS-CoV; Virus Protease

Related Pathways

Anti-infection

Field of Research

Infection

Smiles

O=S(C(F)(F)F)([O-])=O.CC(C)(C)NC1=C(CO[C@]2([C@]3([H])CC(C=C2)=O)C)[N+]3=C4N1C(C5=CC=C(C=C5)OC)=C(C6=CC=C(C=C6)OC)S4

Molecular Formula

C32H34F3N3O7S2

Molecular Weight

693.75

References & Citations

[1]Manandhar A, et al. Discovery of Novel Small-Molecule Inhibitors of SARS-CoV-2 Main Protease as Potential Leads for COVID-19 Treatment. J Chem Inf Model. 2021 Sep 27;61 (9) :4745-4757.