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Compound Detail

CHEMBL165945

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C[C@H]1CN(O)C(=O)[C@H]1N

Basic Information

ChEMBL ID CHEMBL165945
Phase Preclinical
Structure Type MOL
InChI Key SKYSFPFYQBZGDC-IMJSIDKUSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

130.2
MW (Da)
-0.82
ALogP
3
HBA
2
HBD
66.6
PSA (Ų)
0.42
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H10N2O2
MW 130.15
Aromatic Rings 0
Heavy Atoms 9
NP-Likeness 0.76

Activity Summary

IC50 1 meas. best 4.07

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
IC50 4.07 4.07 86000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Glutamate receptor ionotropic, NMDA 1 IC50 = 86000.0 nM 4.07 Inhibition of [3H]glycine binding to rat cortical membranes -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80094-3 Glutamate receptor ionotropic, NMDA 1 1

Data from ChEMBL 36 via Core Engine