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Compound Detail

CHEMBL5279594

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Cc1ccc(S(=O)(=O)N(C)CC(=O)N(Cc2ccc(-c3ccccc3)cc2)c2ccc(C(=O)O)c(O)c2)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5279594
Phase Preclinical
Structure Type MOL
InChI Key DJKGLKUCCOIDET-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

544.6
MW (Da)
4.92
ALogP
5
HBA
2
HBD
115.2
PSA (Ų)
0.31
QED
1
Ro5 Violations
9
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C30H28N2O6S
MW 544.63
Aromatic Rings 4
Heavy Atoms 39
NP-Likeness -1.27

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
31810784 10.1016/j.ejmech.2019.111922 Signal transducer and activator of transcription 3 1

Data from ChEMBL 36 via Core Engine