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Compound Detail

CHEMBL4646662

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Cn1c(=O)c(C(=O)Nc2nccs2)c(O)c2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4646662
Phase Preclinical
Structure Type MOL
InChI Key ATHHWTUOHYVOSR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

301.3
MW (Da)
1.95
ALogP
6
HBA
2
HBD
84.2
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H11N3O3S
MW 301.33
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.43

Literature References

PubMed DOI Target Context # Activities
32146051 10.1016/j.bmcl.2020.127071 Streptococcus pneumoniae 3

Data from ChEMBL 36 via Core Engine