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Compound Detail

CHEMBL436148

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O=C(O)C1CN(CCP(=O)(O)O)CCN1

Basic Information

ChEMBL ID CHEMBL436148
Phase Preclinical
Structure Type MOL
InChI Key QLFSKCJQCKRTLP-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

238.2
MW (Da)
-1.48
ALogP
4
HBA
4
HBD
110.1
PSA (Ų)
0.44
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 C7H15N2O5P
MW 238.18
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness -0.05

Activity Summary

IC50 2 meas. best 5.01

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate NMDA receptor
CHEMBL1907608
IC50 5.01 5.01 9800.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
2145436 10.1021/jm00172a037 Glutamate NMDA receptor 2
1533422 10.1021/jm00086a004 Glutamate NMDA receptor 1

Data from ChEMBL 36 via Core Engine