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Compound Detail

CHEMBL214206

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CCCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)NCCCCCNCCCCCCCCCCN

Basic Information

ChEMBL ID CHEMBL214206
Phase Preclinical
Structure Type MOL
InChI Key GEUDZGLBYPOUTN-SANMLTNESA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

490.7
MW (Da)
4.18
ALogP
5
HBA
5
HBD
116.5
PSA (Ų)
0.16
QED
0
Ro5 Violations
22
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H50N4O3
MW 490.73
Aromatic Rings 1
Heavy Atoms 35
NP-Likeness 0.03

Activity Summary

Ki 3 meas. best 7.58

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor 1
CHEMBL3753
Ki 7.58 6.75 26.0 3

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
16942015 10.1021/jm060606j Glutamate receptor 1 3
16942015 10.1021/jm060606j Glutamate receptor ionotropic, AMPA 1

Data from ChEMBL 36 via Core Engine