BiologicalActivity
Potentandselectivecell-permeablehumanneutrophilelastase(HNE)inhibitor(IC50=20nM).Exhibitsaround2000-foldselectivityforNHEagainstapanelof21otherserineproteases.Effectiveinanacutelunginjurymodelinvivo.Orallybioavailable.InactiveS-enantiomer(Cat.No.6389)alsoavailable.
LicensingInformation
ThiscompoundissuppliedinconjunctionwiththeStructuralGenomicsConsortium.Forfurthercharacterizationdetails,pleasevisittheBAY678probesummaryontheSGCwebsite.
TechnicalData
| M.Wt | 400.35 |
| Formula | C20H15F3N4O2 |
| Storage | Storeat-20°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 675103-36-3 |
| InChIKey | PGIVGIFOWOVINL-GOSISDBHSA-N |
| Smiles | CC(C([C@H]1C2=CN=C(C#N)C=C2)=C(C)N(C3=CC=CC(C(F)(F)F)=C3)C(N1)=O)=O |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 40.03 | 100 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight400.35.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 2.5mL | 12.49mL | 24.98mL |
| 5mM | 0.5mL | 2.5mL | 5mL |
| 10mM | 0.25mL | 1.25mL | 2.5mL |
| 50mM | 0.05mL | 0.25mL | 0.5mL |
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ProductDatasheets
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