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Compound Detail

CHEMBL136568

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CCSCC[N+](C)(C)C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL136568
Phase Preclinical
Structure Type MOL
InChI Key VQASHKXACZTIBQ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

148.3
MW (Da)
1.45
ALogP
1
HBA
0
HBD
0.0
PSA (Ų)
0.43
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H18NS+
MW 148.29
Aromatic Rings 0
Heavy Atoms 9
NP-Likeness -0.34

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
9435905 10.1021/jm970488n Acetylcholinesterase 1

Data from ChEMBL 36 via Core Engine