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Compound Detail

CHEMBL82071

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O=[N+]([O-])c1cc(CNCCP(=O)(O)O)c2nc(O)c(O)nc2c1

Basic Information

ChEMBL ID CHEMBL82071
Phase Preclinical
Structure Type MOL
InChI Key CVVQUZACMDLTGQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

344.2
MW (Da)
0.22
ALogP
8
HBA
5
HBD
178.9
PSA (Ų)
0.21
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H13N4O7P
MW 344.22
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -0.76

Activity Summary

IC50 1 meas. best 6.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
IC50 6.19 6.19 640.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10021939 10.1016/s0960-894x(98)00720-3 Glutamate receptor ionotropic, AMPA 1
10021939 10.1016/s0960-894x(98)00720-3 Glutamate receptor ionotropic, NMDA 1 1
10021939 10.1016/s0960-894x(98)00720-3 Mus musculus 1

Data from ChEMBL 36 via Core Engine