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Compound Detail

CHEMBL152410

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CCCCCC(=O)NC(Cc1ccc(O)cc1)C(=O)NCCCCCCCCNCCCN

Basic Information

ChEMBL ID CHEMBL152410
Phase Preclinical
Structure Type MOL
InChI Key RMPOMJNWSMWXRV-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

462.7
MW (Da)
3.40
ALogP
5
HBA
5
HBD
116.5
PSA (Ų)
0.19
QED
0
Ro5 Violations
20
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H46N4O3
MW 462.68
Aromatic Rings 1
Heavy Atoms 33
NP-Likeness 0.09

Activity Summary

Ki 2 meas. best 7.17

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Glutamate receptor 1
CHEMBL2009
Ki 7.17 6.585 68.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
12477358 10.1021/jm020314s Glutamate receptor 1 2
12477358 10.1021/jm020314s Unchecked 1

Data from ChEMBL 36 via Core Engine