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Compound Detail

CHEMBL316451

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NC(C(=O)O)c1cc(O)cc(O)c1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL316451
Phase Preclinical
Structure Type MOL
InChI Key DFGDRLKNGUTURO-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

217.6
MW (Da)
0.84
ALogP
4
HBA
4
HBD
103.8
PSA (Ų)
0.59
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H8ClNO4
MW 217.61
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness 0.89

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
10893301 10.1021/jm000007r Metabotropic glutamate receptor 1 1
10893301 10.1021/jm000007r Metabotropic glutamate receptor 5 1

Data from ChEMBL 36 via Core Engine