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Compound Detail

CHEMBL446007

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CC[C@H](C)[C@H](N)C(=O)N1CCCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL446007
Phase Preclinical
Structure Type MOL
InChI Key YRLGNCQASLTTNG-QWRGUYRKSA-N
0
Targets
3
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

212.3
MW (Da)
1.76
ALogP
2
HBA
1
HBD
46.3
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H24N2O
MW 212.34
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness -0.41

Activity Summary

IC50 3 meas.

Literature References

PubMed DOI Target Context # Activities
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 8 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 9 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 4 1
18556199 10.1016/j.bmcl.2008.05.080 Dipeptidyl peptidase 2 1

Data from ChEMBL 36 via Core Engine