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Compound Detail

CHEMBL5426174

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CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccc(N)cc3)c2)c(Cl)c1

Basic Information

ChEMBL ID CHEMBL5426174
Phase Preclinical
Structure Type MOL
InChI Key UKROYJHFBHSTHS-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

435.3
MW (Da)
4.90
ALogP
4
HBA
2
HBD
89.3
PSA (Ų)
0.57
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H16Cl2N2O3S
MW 435.33
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness -1.64

Activity Summary

IC50 1 meas. best 5.25

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Ubiquitin carboxyl-terminal hydrolase 28
CHEMBL2157853
IC50 5.25 5.25 5680.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
37075624 10.1016/j.ejmech.2023.115369 Ubiquitin carboxyl-terminal hydrolase 28 2

Data from ChEMBL 36 via Core Engine