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Compound Detail

CHEMBL5074996

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CS(=O)(=O)c1ccc(NS(=O)(=O)c2ccccc2)c(Oc2ccccc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5074996
Phase Preclinical
Structure Type MOL
InChI Key UDESTKILGIYLRG-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

403.5
MW (Da)
3.68
ALogP
5
HBA
1
HBD
89.5
PSA (Ų)
0.68
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H17NO5S2
MW 403.48
Aromatic Rings 3
Heavy Atoms 27
NP-Likeness -1.40

Literature References

PubMed DOI Target Context # Activities
34718128 10.1016/j.bmcl.2021.128421 Unchecked 1

Data from ChEMBL 36 via Core Engine