OXYMETAZOLINE

Search structure
Synonyms:
Status: Approved (1986)
Entry Type: Small molecule
Molecule Category: Parent
ATC: R01AA05
UNII: 8VLN5B44ZY

Structure
InChI Key WYWIFABBXFUGLM-UHFFFAOYSA-N
Smile Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1
InChI
InChI=1S/C16H24N2O/c1-10-8-13(16(3,4)5)15(19)11(2)12(10)9-14-17-6-7-18-14/h8,19H,6-7,9H2,1-5H3,(H,17,18)

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H24N2O
Molecular Weight 260.38
AlogP 2.85
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 44.62
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 19.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Adrenergic receptor
20-347 300 - 2-1000 -
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Serotonin receptor
137 - - 0 -
Other cytosolic protein
- - - 6-6 -

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Rosacea 3 D012393 ClinicalTrials
Erythema 3 D004890 ClinicalTrials
Rhinitis, Allergic, Seasonal 2 D006255 ClinicalTrials
Rhinitis, Allergic, Seasonal 2 D006255 ClinicalTrials
Common Cold 1 D003139 ClinicalTrials
Fecal Incontinence 1 D005242 ClinicalTrials
Hypotension, Orthostatic 1 D007024 ClinicalTrials

Cross References

Resources Reference
ChEBI 7862
ChEMBL CHEMBL762
DrugBank DB00935
DrugCentral 2032
EPA CompTox DTXSID3040691
FDA SRS 8VLN5B44ZY
Human Metabolome Database HMDB0015070
Guide to Pharmacology 124
KEGG C07363
PharmGKB PA164748840
SureChEMBL SCHEMBL24301
ZINC ZINC000000057435
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