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Compound Detail

CHEMBL296889

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COP(=O)(O)C(N)Cc1ccccc1

Basic Information

ChEMBL ID CHEMBL296889
Phase Preclinical
Structure Type MOL
InChI Key GWWYEWPQZPLIRG-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

215.2
MW (Da)
1.35
ALogP
3
HBA
2
HBD
72.5
PSA (Ų)
0.74
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H14NO3P
MW 215.19
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness 0.28

Activity Summary

Ki 1 meas. best 4.37

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Cytosol aminopeptidase
CHEMBL3965
Ki 4.37 4.37 43000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Cytosol aminopeptidase Ki = 43000.0 nM 4.37 Inhibition of Leucine aminopeptidase isolated from porcine kidney. 3625708

Literature References

PubMed DOI Target Context # Activities
3625708 10.1021/jm00392a014 Cytosol aminopeptidase 1

Data from ChEMBL 36 via Core Engine