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Compound Detail

CHEMBL468265

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O=C(Nc1nccs1)c1cc(Cl)ccc1O

Basic Information

ChEMBL ID CHEMBL468265
Phase Preclinical
Structure Type MOL
InChI Key OREAUWXYUKOWDY-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

254.7
MW (Da)
2.75
ALogP
4
HBA
2
HBD
62.2
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H7ClN2O2S
MW 254.70
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -2.11

Activity Summary

IC50 1 meas. best 4.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Calcium-activated potassium channel subunit alpha-1
CHEMBL4304
IC50 4.8 4.8 15848.9 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
19026552 10.1016/j.bmc.2008.10.068 Calcium-activated potassium channel subunit alpha-1 1

Data from ChEMBL 36 via Core Engine