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Compound Detail

CHEMBL174022

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COc1noc(C)c1CC(N)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL174022
Phase Preclinical
Structure Type MOL
InChI Key GIJWLSZIGFUYCJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

200.2
MW (Da)
-0.05
ALogP
5
HBA
2
HBD
98.6
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H12N2O4
MW 200.19
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -0.27

Literature References

PubMed DOI Target Context # Activities
6133955 10.1021/jm00360a021 Glutamate receptor ionotropic, AMPA 1

Data from ChEMBL 36 via Core Engine