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Compound Detail

CHEMBL320957

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NC(CCCCCC(=O)O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL320957
Phase Preclinical
Structure Type MOL
InChI Key YOFPFYYTUIARDI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

189.2
MW (Da)
0.43
ALogP
3
HBA
3
HBD
100.6
PSA (Ų)
0.50
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H15NO4
MW 189.21
Aromatic Rings 0
Heavy Atoms 13
NP-Likeness 1.21

Literature References

PubMed DOI Target Context # Activities
8759641 10.1021/jm9602569 Metabotropic glutamate receptor 1 1
8759641 10.1021/jm9602569 Metabotropic glutamate receptor 2 1
8759641 10.1021/jm9602569 Metabotropic glutamate receptor 6 1

Data from ChEMBL 36 via Core Engine