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Compound Detail

CHEMBL556674

SODIUM OCTYL SULFATE
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CCCCCCCCOS(=O)(=O)[O-].[Na+]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL556674
Name SODIUM OCTYL SULFATE
Phase Preclinical
Structure Type MOL
InChI Key WFRKJMRGXGWHBM-UHFFFAOYSA-M
Parent Compound CHEMBL1208322
Active Moiety CHEMBL1208322
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

210.3
MW (Da)
2.17
ALogP
3
HBA
1
HBD
63.6
PSA (Ų)
0.49
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H17NaO4S
MW 232.28
Aromatic Rings 0
Heavy Atoms 13
NP-Likeness 0.92

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
19534533 10.1021/jm900190q Unchecked 1
19534533 10.1021/jm900190q No relevant target 1

Data from ChEMBL 36 via Core Engine