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

CHEMBL8967

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
CCOC(=O)c1cc2n(n1)C(C(=O)O)Nc1ccccc1-2

Basic Information

ChEMBL ID CHEMBL8967
Phase Preclinical
Structure Type MOL
InChI Key HSBLRRODYNZXAF-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

287.3
MW (Da)
1.74
ALogP
6
HBA
2
HBD
93.5
PSA (Ų)
0.84
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H13N3O4
MW 287.27
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -0.83

Activity Summary

Ki 2 meas. best 4.48

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
Ki 4.48 4.48 33300.0 1
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 4.38 4.38 42000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
12954059 10.1021/jm030833a Glutamate receptor ionotropic, AMPA 1
12954059 10.1021/jm030833a Glutamate receptor ionotropic, NMDA 1 1
11855983 10.1021/jm010995b Glutamate receptor ionotropic, NMDA 1 1
11855983 10.1021/jm010995b Glutamate receptor ionotropic, AMPA 1
11855983 10.1021/jm010995b Glutamate receptor ionotropic, kainate 1

Data from ChEMBL 36 via Core Engine