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Compound Detail

CHEMBL243723

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Cc1nc(CC(=O)O)c[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL243723
Phase Preclinical
Structure Type MOL
InChI Key KDUUAAQFXVENJT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

140.1
MW (Da)
0.35
ALogP
2
HBA
2
HBD
66.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C6H8N2O2
MW 140.14
Aromatic Rings 1
Heavy Atoms 10
NP-Likeness -0.78

Literature References

PubMed DOI Target Context # Activities
17655213 10.1021/jm070447j Unchecked 3

Data from ChEMBL 36 via Core Engine