BiologicalActivity
PotentALKinhibitor(IC50valuesare1.3,2.4,85.8,2,133and9,276nMforALK2,ALK1,ALK3,ALK4andALK5,respectively).ExhibitsselectivityforALK2overALK4andALK5incellularassays.InhibitsheterotopicossificationinamutantALK2mousemodeloffibrodysplasiaossificansprogressiva.AlsoexhibitsactivityagainstRIPK2,ABL1andPDGFR-β(IC50values<100nM).
LicensingInformation
SoldforresearchpurposesunderexclusiveagreementfromTheBrighamandWomen"sHospitalInc.USpatent14/776,302
TechnicalData
| M.Wt | 406.48 |
| Formula | C25H22N6 |
| Storage | Storeat-20°C |
| Purity | ≥98%(HPLC) |
| CASNumber | 1432597-26-6 |
| PubChemID | 60182388 |
| InChIKey | BBDGBGOVJPEFBT-UHFFFAOYSA-N |
| Smiles | N1(C2=CC=C(C3=CN4N=CC(C5=CC=CC6=C5C=CC=N6)=C4N=C3)C=C2)CCNCC1 |
Thetechnicaldataprovidedaboveisforguidanceonly.ForbatchspecificdatarefertotheCertificateofAnalysis.
AllTocrisproductsareintendedforlaboratoryresearchuseonly.
SolubilityData
| Solvent | MaxConc.mg/mL | MaxConc.mM | |
|---|---|---|---|
| Solubility | |||
| DMSO | 1.02 | 2.5mMwithgentlewarming | |
| 2eq.HCl | 20.32 | 50 |
PreparingStockSolutions
Thefollowingdataisbasedontheproductmolecularweight406.48.Batchspecificmolecularweightsmayvaryfrombatchtobatchduetosolventofhydration,whichwillaffectthesolventvolumesrequiredtopreparestocksolutions.
| Concentration/SolventVolume/Mass | 1mg | 5mg | 10mg |
|---|---|---|---|
| 1mM | 2.46mL | 12.3mL | 24.6mL |
| 5mM | 0.49mL | 2.46mL | 4.92mL |
| 10mM | 0.25mL | 1.23mL | 2.46mL |
| 50mM | 0.05mL | 0.25mL | 0.49mL |
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