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Compound Detail

CHEMBL4440066

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CN(C)CCOc1cc(NC(=O)c2ccc3c(c2)COB3O)ccc1Cl

Basic Information

ChEMBL ID CHEMBL4440066
Phase Preclinical
Structure Type MOL
InChI Key WUJGFQGAACZVHH-UHFFFAOYSA-N
5
Targets
6
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

374.6
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H20BClN2O4
MW 374.63

Activity Summary

EC50 6 meas. best 5.7

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Leishmania aethiopica
CHEMBL612651
EC50 5.7 5.7 2000.0 1
Leishmania major
CHEMBL612879
EC50 5.7 5.7 2000.0 1
Leishmania mexicana
CHEMBL612880
EC50 5.7 5.7 2000.0 1
Leishmania tropica
CHEMBL612881
EC50 5.7 5.7 2000.0 2
Leishmania panamensis
CHEMBL612882
EC50 5.7 5.7 2000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
31288128 10.1016/j.ejmech.2019.06.092 Leishmania tropica 2
31288128 10.1016/j.ejmech.2019.06.092 Leishmania major 1
31288128 10.1016/j.ejmech.2019.06.092 Leishmania panamensis 1
31288128 10.1016/j.ejmech.2019.06.092 Leishmania aethiopica 1
31288128 10.1016/j.ejmech.2019.06.092 Leishmania mexicana 1

Data from ChEMBL 36 via Core Engine