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Compound Detail

CHEMBL290357

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CC(C)CC(N)P(=O)(O)CC(Cc1ccccc1)C(=O)NC(Cc1ccccc1)C(=O)O

Basic Information

ChEMBL ID CHEMBL290357
Phase Preclinical
Structure Type MOL
InChI Key TXXKMCPWNCYHRN-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

460.5
MW (Da)
3.26
ALogP
4
HBA
4
HBD
129.7
PSA (Ų)
0.36
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H33N2O5P
MW 460.51
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness 0.16

Activity Summary

Ki 2 meas. best 8.49

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Aminopeptidase N
CHEMBL2590
Ki 8.49 7.77 3.2 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10386926 10.1016/s0960-894x(99)00236-x Aminopeptidase N 2

Data from ChEMBL 36 via Core Engine