Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 8S2C9V11K4

Structure

InChI Key JYYLVUFNAHSSFE-UHFFFAOYSA-N
Smile Cn1c(=O)c(Oc2ccc(F)cc2F)cc2cnc(NC(CCO)CCO)nc21
InChI
InChI=1S/C19H20F2N4O4/c1-25-17-11(10-22-19(24-17)23-13(4-6-26)5-7-27)8-16(18(25)28)29-15-3-2-12(20)9-14(15)21/h2-3,8-10,13,26-27H,4-7H2,1H3,(H,22,23,24)

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H20F2N4O4
Molecular Weight 406.39
AlogP 1.94
Hydrogen Bond Acceptor 8.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 8.0
Polar Surface Area 109.5
Molecular species NEUTRAL
Aromatic Rings 3.0
Heavy Atoms 29.0

Pharmacology

Action Mechanism of Action Reference
INHIBITOR MAP kinase p38 alpha inhibitor PubMed

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 90685
ChEMBL CHEMBL1090089
FDA SRS 8S2C9V11K4
Guide to Pharmacology 9915
PDB FLW
PubChem 16220188
SureChEMBL SCHEMBL3636701
ZINC ZINC000030691792