TYRAMINE

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Synonyms
Status
Molecule Category Free-form
UNII X8ZC7V0OX3
EPA CompTox DTXSID2043874

Structure

InChI Key DZGWFCGJZKJUFP-UHFFFAOYSA-N
Smiles NCCc1ccc(O)cc1
InChI
InChI=1S/C8H11NO/c9-6-5-7-1-3-8(10)4-2-7/h1-4,10H,5-6,9H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H11NO
Molecular Weight 137.18
AlogP 0.89
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 46.25
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 10.0

Pharmacology

Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Enzyme Oxidoreductase
- - - - 23
Membrane receptor Family A G protein-coupled receptor Small molecule receptor (family A GPCR) Monoamine receptor Trace amine receptor
69-731 - - - -
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 59.9-85.38
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 59.9-85.38
Homo sapiens
76-731 - - - 23
Rattus norvegicus
69 - - - -

Cross References

Resources Reference
ChEBI 15760
ChEMBL CHEMBL11608
DrugBank DB08841
DrugCentral 2784
FDA SRS X8ZC7V0OX3
Human Metabolome Database HMDB0000306
Guide to Pharmacology 2150
KEGG C00483
PDB AEF
PubChem 5610
SureChEMBL SCHEMBL4111
ZINC ZINC000000002233
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