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Compound Detail

CHEMBL119365

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O=C(O)c1nc2cc(N3CCC(O)CC3)c([N+](=O)[O-])cc2nc1O

Basic Information

ChEMBL ID CHEMBL119365
Phase Preclinical
Structure Type MOL
InChI Key ZQFPONXEYKXVBL-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

334.3
MW (Da)
0.90
ALogP
8
HBA
3
HBD
149.9
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 C14H14N4O6
MW 334.29
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness -0.94

Activity Summary

Ki 1 meas. best 5.6

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 5.6 5.6 2500.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
14505662 10.1016/s0960-894x(03)00740-6 Glutamate receptor ionotropic, AMPA 1

Data from ChEMBL 36 via Core Engine