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Compound Detail

CHEMBL109207

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CCc1nnc2c(O)nc3cc(Cl)c(Cl)cc3n12

Basic Information

ChEMBL ID CHEMBL109207
Phase Preclinical
Structure Type MOL
InChI Key WFYBMPUPRLPKIT-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

283.1
MW (Da)
2.85
ALogP
5
HBA
1
HBD
63.3
PSA (Ų)
0.75
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 C11H8Cl2N4O
MW 283.12
Aromatic Rings 3
Heavy Atoms 18
NP-Likeness -1.71

Activity Summary

Ki 2 meas. best 5.34

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
Ki 5.34 5.34 4580.0 1
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 5.32 5.32 4780.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1382133 10.1021/jm00096a002 Glutamate receptor ionotropic, AMPA 1
1382133 10.1021/jm00096a002 Glutamate receptor ionotropic, NMDA 1 1

Data from ChEMBL 36 via Core Engine