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Compound Detail

CHEMBL41352

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CNC(C(=O)O)c1cc(O)no1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL41352
Phase Preclinical
Structure Type MOL
InChI Key WQILXFDLXYKVFJ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

172.1
MW (Da)
-0.27
ALogP
5
HBA
3
HBD
95.6
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C6H8N2O4
MW 172.14
Aromatic Rings 1
Heavy Atoms 12
NP-Likeness -0.38

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
9873391 10.1016/s0960-894x(98)00264-9 Metabotropic glutamate receptor 1 1
9873391 10.1016/s0960-894x(98)00264-9 Metabotropic glutamate receptor 2 1
9873391 10.1016/s0960-894x(98)00264-9 Metabotropic glutamate receptor 4 1
9873391 10.1016/s0960-894x(98)00264-9 Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine