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Compound Detail

CHEMBL306851

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O=C(O)CC[C@@H]1CC[C@H]2CN[C@H](C(=O)O)C[C@H]2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL306851
Phase Preclinical
Structure Type MOL
InChI Key IJYIQCVVNGGYEV-MMWGEVLESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

255.3
MW (Da)
1.33
ALogP
3
HBA
3
HBD
86.6
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H21NO4
MW 255.31
Aromatic Rings 0
Heavy Atoms 18
NP-Likeness 1.37

Literature References

PubMed DOI Target Context # Activities
8667366 10.1021/jm950913h Glutamate NMDA receptor 2
8667366 10.1021/jm950913h Glutamate receptor ionotropic, AMPA 2
8667366 10.1021/jm950913h Glutamate receptor ionotropic, kainate 2

Data from ChEMBL 36 via Core Engine