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Compound Detail

CHEMBL58404

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O=C1CC(C(=O)O)Nc2ccccc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL58404
Phase Preclinical
Structure Type MOL
InChI Key VYOPZMJTHXGKID-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

191.2
MW (Da)
1.14
ALogP
3
HBA
2
HBD
66.4
PSA (Ų)
0.70
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C10H9NO3
MW 191.19
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness 0.54

Literature References

PubMed DOI Target Context # Activities
1534583 10.1021/jm00089a003 Glutamate NMDA receptor 1
1534583 10.1021/jm00089a003 Glutamate receptors; NMDA/AMPA 1

Data from ChEMBL 36 via Core Engine