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Compound Detail

CHEMBL106433

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CCOC(=O)c1nc2c(O)nc3cc(-n4cnnc4)ccc3n2n1

Basic Information

ChEMBL ID CHEMBL106433
Phase Preclinical
Structure Type MOL
InChI Key BJFMJOVUIYXTOP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

325.3
MW (Da)
0.74
ALogP
10
HBA
1
HBD
120.3
PSA (Ų)
0.55
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 C14H11N7O3
MW 325.29
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -1.77

Activity Summary

Ki 1 meas. best 5.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 5.0 5.0 10100.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11543685 10.1021/jm010862q Glutamate receptor ionotropic, AMPA 1
11543685 10.1021/jm010862q Glutamate NMDA receptor 1
11543685 10.1021/jm010862q Glutamate receptor ionotropic, kainate 1

Data from ChEMBL 36 via Core Engine