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Compound Detail

CHEMBL273662

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O=P(O)(O)Cc1cc(Br)cc2nc(O)c(O)nc12

Basic Information

ChEMBL ID CHEMBL273662
Phase Preclinical
Structure Type MOL
InChI Key BZTFZEXQWFKEJC-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

335.1
MW (Da)
1.48
ALogP
5
HBA
4
HBD
123.8
PSA (Ų)
0.61
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 C9H8BrN2O5P
MW 335.05
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.32

Activity Summary

IC50 1 meas. best 8.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate [NMDA] receptor
CHEMBL2094124
IC50 8.82 8.82 1.5 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11909726 10.1016/s0960-894x(02)00074-4 Glutamate [NMDA] receptor 1
11909726 10.1016/s0960-894x(02)00074-4 Mus musculus 1

Data from ChEMBL 36 via Core Engine