Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL28623

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
NCCCC[C@H](N)C(=O)CC(Cc1ccccc1)C(=O)O

Basic Information

ChEMBL ID CHEMBL28623
Phase Preclinical
Structure Type MOL
InChI Key LIJBAQFOQWDLOJ-KZUDCZAMSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

292.4
MW (Da)
1.35
ALogP
4
HBA
3
HBD
106.4
PSA (Ų)
0.56
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H24N2O3
MW 292.38
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.75

Activity Summary

Ki 1 meas. best 8.4

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Aminopeptidase B
CHEMBL2452
Ki 8.4 8.4 4.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
2566685 10.1021/jm00126a039 Leucyl-cystinyl aminopeptidase 2
2566685 10.1021/jm00126a039 Aminopeptidase B 1

Data from ChEMBL 36 via Core Engine