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Compound Detail

CHEMBL142872

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O=[N+]([O-])c1cc2nc(O)c(O)nc2cc1-c1c[nH]cn1

Basic Information

ChEMBL ID CHEMBL142872
Phase Preclinical
Structure Type MOL
InChI Key CCDMTBWWYPHEAW-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

273.2
MW (Da)
1.34
ALogP
7
HBA
3
HBD
138.1
PSA (Ų)
0.47
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H7N5O4
MW 273.21
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.64

Activity Summary

Ki 1 meas. best 6.16

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 6.16 6.16 690.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
8120865 10.1021/jm00030a006 Glutamate receptor ionotropic, AMPA 1

Data from ChEMBL 36 via Core Engine