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Compound Detail

CHEMBL5595842

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CN(C)C(=O)c1nc(-c2ccccc2)[nH]c(=O)c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5595842
Phase Preclinical
Structure Type MOL
InChI Key XGJRGRQVFLRJID-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

259.3
MW (Da)
0.84
ALogP
4
HBA
2
HBD
86.3
PSA (Ų)
0.84
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H13N3O3
MW 259.26
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.92

Literature References

PubMed DOI Target Context # Activities
39015284 10.1021/acsmedchemlett.3c00453 Unchecked 2

Data from ChEMBL 36 via Core Engine