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Compound Detail

CHEMBL308011

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C[C@@H]1CCN[C@@H](C(=O)O)[C@H]1C(=O)CP(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL308011
Phase Preclinical
Structure Type MOL
InChI Key OUFBJKZYYGXNIJ-LPBLVHEISA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

265.2
MW (Da)
-0.57
ALogP
4
HBA
4
HBD
123.9
PSA (Ų)
0.50
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 C9H16NO6P
MW 265.20
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 0.97

Activity Summary

IC50 1 meas. best 7.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate NMDA receptor
CHEMBL1907608
 IC50 7.82 7.82 15.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Glutamate NMDA receptor IC50 = 15.0 nM 7.82 Binding potency for NMDA site of the glutamate receptor complex using rat brain ... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80084-0 Glutamate NMDA receptor 1

Data from ChEMBL 36 via Core Engine