PHENIRAMINE MALEATE

Search structure
Synonyms:
Status: Approved (1994)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: NYW905655B

Structure
InChI Key SSOXZAQUVINQSA-BTJKTKAUSA-N
Smile CN(C)CCC(c1ccccc1)c1ccccn1.O=C(O)/C=C\C(=O)O
InChI
InChI=1S/C16H20N2.C4H4O4/c1-18(2)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;5-3(6)1-2-4(7)8/h3-10,12,15H,11,13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1-

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H24N2O4
Molecular Weight 356.42
AlogP 3.17
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 5.0
Polar Surface Area 16.13
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 18.0

Pharmacology

Action Mechanism of Action Reference
ANTAGONIST Histamine H1 receptor antagonist
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Transferase
- - - - 16.03
Epigenetic regulator Eraser Histone deacetylase HDAC class IIb
- - - - -50.84--2.22
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Histamine receptor
0.0068 - - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 103.16

Indications

Mesh Heading Maximum Phase Mesh ID Reference
Common Cold 3 D003139 ClinicalTrials
Influenza, Human 3 D007251 ClinicalTrials
Respiratory Tract Infections 3 D012141 ClinicalTrials
Respiratory Tract Diseases 3 D012140 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 31990
ChEMBL CHEMBL1653
EPA CompTox DTXSID0025866
FDA SRS NYW905655B
KEGG C12574
PubChem 25150753
SureChEMBL SCHEMBL25318
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