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Compound Detail

CHEMBL21826

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O=C(O)c1cc(O)c2cccc(Cl)c2n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL21826
Phase Preclinical
Structure Type MOL
InChI Key HLBJQGJKDNDEPD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

223.6
MW (Da)
2.29
ALogP
3
HBA
2
HBD
70.4
PSA (Ų)
0.78
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 C10H6ClNO3
MW 223.62
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -0.66

Literature References

PubMed DOI Target Context # Activities
1826744 10.1021/jm00108a002 Glutamate NMDA receptor 2
1826744 10.1021/jm00108a002 Glutamate receptor ionotropic, AMPA 1
1826744 10.1021/jm00108a002 Glutamate receptor ionotropic, kainate 1

Data from ChEMBL 36 via Core Engine