DILMAPIMOD

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Synonyms
Status
Molecule Category Free-form
UNII Q3238VQW0N

Structure

InChI Key ORVNHOYNEHYKJG-UHFFFAOYSA-N
Smiles Cc1cc(F)ccc1-c1nc(NC(CO)CO)nc2c1ccc(=O)n2-c1c(F)cccc1F
InChI
InChI=1S/C23H19F3N4O3/c1-12-9-13(24)5-6-15(12)20-16-7-8-19(33)30(21-17(25)3-2-4-18(21)26)22(16)29-23(28-20)27-14(10-31)11-32/h2-9,14,31-32H,10-11H2,1H3,(H,27,28,29)

Physicochemical Descriptors

Property Name Value
Molecular Formula C23H19F3N4O3
Molecular Weight 456.42
AlogP 2.94
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 100.27
Molecular species NEUTRAL
Aromatic Rings 4.0
Heavy Atoms 33.0

Pharmacology

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

Target Conservation

Protein: MAP kinase p38 alpha
Description: Mitogen-activated protein kinase 14
Organism : Homo sapiens
Q16539 ENSG00000112062

Cross References

Resources Reference
ChEMBL CHEMBL2103838
DrugBank DB12140
FDA SRS Q3238VQW0N
Guide to Pharmacology 7815
PubChem 10297982
SureChEMBL SCHEMBL1065268
ZINC ZINC000034997404
CONTENTS