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Compound Detail

CHEMBL309206

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OCc1nc2c(O)nc3cc(Cl)ccc3n2n1

Basic Information

ChEMBL ID CHEMBL309206
Phase Preclinical
Structure Type MOL
InChI Key RFRZUJVOHYCYRG-UHFFFAOYSA-N
2
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

250.7
MW (Da)
1.13
ALogP
6
HBA
2
HBD
83.5
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H7ClN4O2
MW 250.65
Aromatic Rings 3
Heavy Atoms 17
NP-Likeness -1.47

Activity Summary

Ki 4 meas. best 5.36

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 5.36 5.36 4400.0 2
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
Ki 5.12 5.12 7500.0 2

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
10395489 10.1021/jm981102r Glutamate receptor ionotropic, NMDA 1 1
10395489 10.1021/jm981102r Glutamate receptor ionotropic, AMPA 1

Data from ChEMBL 36 via Core Engine