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Compound Detail

CHEMBL5409128

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CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Cl)c(-c3ccc(NC(=O)C4CC4)cc3)c2)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5409128
Phase Preclinical
Structure Type MOL
InChI Key LUMDAUKYDAMGFM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

503.4
MW (Da)
5.66
ALogP
4
HBA
2
HBD
92.3
PSA (Ų)
0.45
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H20Cl2N2O4S
MW 503.41
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -1.79

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