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Compound Detail

CHEMBL1209651

TETRAMETHYLAMMONIUM
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C[N+](C)(C)C.[Cl-]

Basic Information

ChEMBL ID CHEMBL1209651
Name TETRAMETHYLAMMONIUM
Phase Preclinical
Structure Type MOL
InChI Key OKIZCWYLBDKLSU-UHFFFAOYSA-M
Parent Compound CHEMBL46486
Active Moiety CHEMBL46486
1
Targets
10
Activities
2
Assay Types
0
PK Parameters
11
Publications
0
Known Names

Molecular Properties

74.2
MW (Da)
0.32
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.36
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C4H12ClN
MW 109.60
Aromatic Rings 0
Heavy Atoms 5
NP-Likeness 0.31

Activity Summary

Ki 6 meas. best 4.52
IC50 4 meas.

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
High affinity choline transporter 1
CHEMBL3013
Ki 4.52 4.52 30060.8 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10688634 - Solute carrier family 22 member 1 3
20637607 10.1016/j.bmcl.2010.06.090 High affinity choline transporter 1 1
11060354 - Solute carrier family 22 member 1 1
10454528 - Organic cation/carnitine transporter 2 1
9632645 10.1074/jbc.273.26.15971 Solute carrier family 22 member 3 1
11758759 10.1023/a:1013070128668 Solute carrier family 22 member 1 1
12240953 10.1023/a:1019870831174 Solute carrier family 22 member 2 1
11758759 10.1023/a:1013070128668 Solute carrier family 22 member 2 1
11502595 10.1152/ajprenal.2001.281.3.f454 Solute carrier family 22 member 2 1
7990927 10.1038/372549a0 Solute carrier family 22 member 1 1
9260930 10.1089/dna.1997.16.871 Solute carrier family 22 member 2 1

Data from ChEMBL 36 via Core Engine