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Compound Detail

CHEMBL1078612

TETRABUTYLAMMONIUM
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CCCC[N+](CCCC)(CCCC)CCCC.[Cl-]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1078612
Name TETRABUTYLAMMONIUM
Phase Preclinical
Structure Type MOL
InChI Key NHGXDBSUJJNIRV-UHFFFAOYSA-M
Parent Compound CHEMBL1236196
Active Moiety CHEMBL1236196
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

242.5
MW (Da)
5.00
ALogP
0
HBA
0
HBD
0.0
PSA (Ų)
0.42
QED
1
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H36ClN
MW 277.92
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 0.12

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
19660946 10.1016/j.bmcl.2009.07.066 Staphylococcus epidermidis 2
19660946 10.1016/j.bmcl.2009.07.066 Escherichia coli 2
20637607 10.1016/j.bmcl.2010.06.090 High affinity choline transporter 1 1

Data from ChEMBL 36 via Core Engine