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Compound Detail

CHEMBL318226

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Cc1cc2[nH]c(=O)c(=O)n(CP(=O)(O)O)c2cc1C

Basic Information

ChEMBL ID CHEMBL318226
Phase Preclinical
Structure Type MOL
InChI Key YDZCBCLZROADAZ-UHFFFAOYSA-N
4
Targets
4
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

284.2
MW (Da)
0.44
ALogP
4
HBA
3
HBD
112.4
PSA (Ų)
0.55
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 C11H13N2O5P
MW 284.21
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.41

Activity Summary

Ki 4 meas. best 5.92

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor ionotropic, AMPA
CHEMBL2093871
Ki 5.92 5.92 1210.0 1
Glutamate receptor ionotropic AMPA
CHEMBL2096670
Ki 5.92 5.92 1210.0 1
Glutamate [NMDA] receptor
CHEMBL2094124
Ki 5.28 5.28 5280.0 1
Glutamate receptor ionotropic, NMDA 1
CHEMBL330
Ki 5.28 5.28 5280.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80768-X Glutamate receptor ionotropic, AMPA 1
- 10.1016/S0960-894X(01)80768-X Glutamate receptor ionotropic, NMDA 1 1
34998058 10.1016/j.ejmech.2021.114085 Glutamate receptor ionotropic AMPA 1
34998058 10.1016/j.ejmech.2021.114085 Glutamate [NMDA] receptor 1

Data from ChEMBL 36 via Core Engine