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Compound Detail

CHEMBL5564772

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NCC(O)CNS(=O)(=O)c1ccccc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5564772
Phase Preclinical
Structure Type MOL
InChI Key XRJZVFBXOJFVLU-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

248.3
MW (Da)
-0.58
ALogP
4
HBA
3
HBD
92.4
PSA (Ų)
0.65
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H13FN2O3S
MW 248.28
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -1.61

Activity Summary

Kd 1 meas.

Literature References

PubMed DOI Target Context # Activities
38932616 10.1021/acs.jmedchem.4c00702 Lysosomal acid glucosylceramidase 1

Data from ChEMBL 36 via Core Engine