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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL1209651
CHEMBL1209651
Compound Name TETRAMETHYLAMMONIUM
ChEMBL Synonyms Tetramethylammonium
Max Phase 0
Trade Names
Molecular Formula C4H12ClN

Additional synonyms for CHEMBL1209651 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES [Cl-].C[N+](C)(C)C
Standard InChI InChI=1S/C4H12N.ClH/c1-5(2,3)4;/h1-4H3;1H/q+1;/p-1
Standard InChI Key OKIZCWYLBDKLSU-UHFFFAOYSA-M

Sources

  • PubChem BioAssays
  • Scientific Literature
  • TP-search Transporter Database

Alternate Forms of Compound in ChEMBL


CHEMBL1209651

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
74.2 74.0964 0.32 0 0 -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
0 0 0 1 0 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - -2.9 -2.9 0 5 0.36

Structural Alerts

There are 1 structural alerts for CHEMBL1209651. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:OKIZCWYLBDKLSU-UHFFFAOYSA-M
PubChem SID: 144207858

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL1209651



ACToR 251459-49-1 75-57-0
Brenda 20538
ChEBI 7070
ChemicalBook CB9118809
eMolecules 529970
EPA CompTox Dashboard DTXSID6021749
FDA SRS DCQ9S88703
IBM Patent System CE9F07A734390A2AB02732EEEF070766
KEGG Ligand C11335
MolPort MolPort-001-795-076
PubChem 3248084 6379
PubChem: Thomson Pharma 15194322
SureChEMBL SCHEMBL35736

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