Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL50744

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(O)CCc1cc(C(=O)O)nc2ccccc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL50744
Phase Preclinical
Structure Type MOL
InChI Key JFSBHXRYWNSQDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

245.2
MW (Da)
1.95
ALogP
3
HBA
2
HBD
87.5
PSA (Ų)
0.86
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 C13H11NO4
MW 245.23
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.21

Literature References

PubMed DOI Target Context # Activities
1534125 10.1021/jm00088a014 Glutamate NMDA receptor 1
1534125 10.1021/jm00088a014 NON-PROTEIN TARGET 1

Data from ChEMBL 36 via Core Engine