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Compound Detail

CHEMBL478460

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NS(=O)(=O)c1cccc(NC(=O)c2cc3ccccc3oc2=O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL478460
Phase Preclinical
Structure Type MOL
InChI Key PWLWIGDDUUFPAT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

344.4
MW (Da)
1.69
ALogP
5
HBA
2
HBD
119.5
PSA (Ų)
0.70
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H12N2O5S
MW 344.35
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -1.63

Literature References

PubMed DOI Target Context # Activities
18805693 10.1016/j.bmcl.2008.09.030 Unchecked 1
18805693 10.1016/j.bmcl.2008.09.030 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine