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Compound Detail

CHEMBL234549

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ClCCOC[C@H]1CO1

Basic Information

ChEMBL ID CHEMBL234549
Phase Preclinical
Structure Type MOL
InChI Key SLHJJBZBHQIKBB-YFKPBYRVSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

136.6
MW (Da)
0.64
ALogP
2
HBA
0
HBD
21.8
PSA (Ų)
0.32
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 C5H9ClO2
MW 136.58
Aromatic Rings 0
Heavy Atoms 8
NP-Likeness -0.13

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
17287124 10.1016/j.bmc.2007.01.040 ADMET 1
17287124 10.1016/j.bmc.2007.01.040 Sindbis virus 1

Data from ChEMBL 36 via Core Engine