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Compound Detail

CHEMBL199233

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N[C@@H](Cn1c(=O)ccn(CC(=O)O)c1=O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL199233
Phase Preclinical
Structure Type MOL
InChI Key LHILPKNXWWAWKH-YFKPBYRVSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

257.2
MW (Da)
-2.49
ALogP
7
HBA
3
HBD
144.6
PSA (Ų)
0.53
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H11N3O6
MW 257.20
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.46

Literature References

PubMed DOI Target Context # Activities
16302825 10.1021/jm050584l Glutamate receptor ionotropic, AMPA 3
16302825 10.1021/jm050584l Glutamate receptor ionotropic, kainate 1 1
16302825 10.1021/jm050584l Glutamate receptor ionotropic, kainate 2 1

Data from ChEMBL 36 via Core Engine