REVAMILAST

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 30LE65637T

Structure
InChI Key IXQHNBONEVULTL-UHFFFAOYSA-N
Smile O=C(Nc1c(Cl)c[n+]([O-])cc1Cl)c1ccc(OC(F)F)c2oc3ccncc3c12
InChI
InChI=1S/C18H9Cl2F2N3O4/c19-10-6-25(27)7-11(20)15(10)24-17(26)8-1-2-13(29-18(21)22)16-14(8)9-5-23-4-3-12(9)28-16/h1-7,18H,(H,24,26)

Physicochemical Descriptors

Property Name Value
Molecular Formula C18H9Cl2F2N3O4
Molecular Weight 440.19
AlogP 4.77
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 4.0
Polar Surface Area 91.3
Molecular species NEUTRAL
Aromatic Rings 4.0
Heavy Atoms 29.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4A
- 3 - - -
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4B
- 3 - - -
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4C
- 3 - - -
Enzyme Phosphodiesterase Phosphodiesterase 4 Phosphodiesterase 4D
- 3 - - -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Asthma 2 D001249 ClinicalTrials
Arthritis, Rheumatoid 2 D001172 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 893555-90-3
ChEMBL CHEMBL4297527
DrugBank DB11838
FDA SRS 30LE65637T
Guide to Pharmacology 9865
PubChem 11546664
SureChEMBL SCHEMBL19205850
CONTENTS