ARRY-797

Search structure
Synonyms:
Status: Phase 3
Entry Type: Small molecule
Molecule Category: UNKNOWN

Structure
InChI Key IFGWYHGYNVGVRB-UHFFFAOYSA-N
Smile CC(C)Cn1ncc2cc(Oc3ccc(F)cc3F)c(C(=O)NCCN(C)C)cc21
InChI
InChI=1S/C22H26F2N4O2/c1-14(2)13-28-19-11-17(22(29)25-7-8-27(3)4)21(9-15(19)12-26-28)30-20-6-5-16(23)10-18(20)24/h5-6,9-12,14H,7-8,13H2,1-4H3,(H,25,29)

Physicochemical Descriptors

Property Name Value
Molecular Formula C22H26F2N4O2
Molecular Weight 416.47
AlogP 4.05
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 8.0
Polar Surface Area 59.39
Molecular species BASE
Aromatic Rings 3.0
Heavy Atoms 30.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR MAP kinase p38 alpha inhibitor PubMed Other
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Kinase Protein Kinase CMGC protein kinase group CMGC protein kinase MAPK family CMGC protein kinase p38 subfamily
- 5 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Cardiomyopathy, Dilated 3 D002311 ClinicalTrials
Spondylitis, Ankylosing 2 D013167 ClinicalTrials
Osteoarthritis, Knee 2 D020370 ClinicalTrials
Toothache 2 D014098 ClinicalTrials
Arthritis, Rheumatoid 1 D001172 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL1088750
Guide to Pharmacology 11095
SureChEMBL SCHEMBL222635
ZINC ZINC000049109970
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