JNJ-39220675

Search structure
Synonyms:
Status: Phase 2
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 41WC0AZ27V

Structure
InChI Key IQOWHZHNGJXGHG-UHFFFAOYSA-N
Smile O=C(c1ccc(Oc2ccc(F)cc2)nc1)N1CCCN(C2CCC2)CC1
InChI
InChI=1S/C21H24FN3O2/c22-17-6-8-19(9-7-17)27-20-10-5-16(15-23-20)21(26)25-12-2-11-24(13-14-25)18-3-1-4-18/h5-10,15,18H,1-4,11-14H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C21H24FN3O2
Molecular Weight 369.44
AlogP 3.71
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 45.67
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 27.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Histamine H3 receptor antagonist PubMed PubMed PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Ion channel Voltage-gated ion channel Potassium channels Voltage-gated potassium channel
- - - - 23
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Histamine receptor
- - 0 1 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Rhinitis, Allergic, Seasonal 2 D006255 ClinicalTrials

Cross References

Resources Reference
CAS NUMBER 959740-39-7
ChEMBL CHEMBL1171754
DrugBank DB12929
EPA CompTox DTXSID90242053
FDA SRS 41WC0AZ27V
PubChem 24771368
SureChEMBL SCHEMBL524288
ZINC ZINC000053298428
CONTENTS