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Compound Detail

CHEMBL434886

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CCC(C)C(N)C(=O)N(C)CC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL434886
Phase Preclinical
Structure Type MOL
InChI Key IUVAYAARSQMGGM-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

172.3
MW (Da)
0.84
ALogP
2
HBA
1
HBD
46.3
PSA (Ų)
0.68
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 C9H20N2O
MW 172.27
Aromatic Rings 0
Heavy Atoms 12
NP-Likeness -0.16

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
14584950 10.1021/jm0308803 Dipeptidyl peptidase 4 2
14584950 10.1021/jm0308803 Dipeptidyl peptidase 2 1

Data from ChEMBL 36 via Core Engine