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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1255790
CHEMBL1255790
Compound Name TYRAMINE HYDROCHLORIDE
ChEMBL Synonyms 4-Hydroxyphenethylamine Hydrochloride
Max Phase 0
Trade Names
Molecular Formula C8H12ClNO

Additional synonyms for CHEMBL1255790 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES Cl.NCCc1ccc(O)cc1
Standard InChI InChI=1S/C8H11NO.ClH/c9-6-5-7-1-3-8(10)4-2-7;/h1-4,10H,5-6,9 ...
Download InChI
Standard InChI Key RNISDHSYKZAWOK-UHFFFAOYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL1255790

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
137.2 137.0841 0.89 2 46.25 BASE


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
2 2 0 2 3 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
9.51 10.49 .78 -1.76 1 10 0.64

Structural Alerts

There are no structural alerts for CHEMBL1255790

Compound Cross References

ChemSpider ChemSpider:RNISDHSYKZAWOK-UHFFFAOYSA-N
PubChem SID: 144208396 SID: 17388673 SID: 50107051

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1255790



ACToR 60-19-5
ChemicalBook CB7345058
eMolecules 533065
EPA CompTox Dashboard DTXSID8034087
FDA SRS Z5KDH3H147
Mcule MCULE-6739710688
MolPort MolPort-003-889-295
PubChem 66449 10965017 44828551
PubChem: Thomson Pharma 16532912 16020515
SureChEMBL SCHEMBL16145274 SCHEMBL2121

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/RNISDHSYKZAWOK-UHFFFAOYSA-N spacer
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