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Compound Detail

CHEMBL395185

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CC(C)(C)[C@H](N)C(=O)N1CC[C@@H]2C[C@H]21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL395185
Phase Preclinical
Structure Type MOL
InChI Key KPKPMCMQUNWDEQ-IWSPIJDZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

196.3
MW (Da)
0.98
ALogP
2
HBA
1
HBD
46.3
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H20N2O
MW 196.29
Aromatic Rings 0
Heavy Atoms 14
NP-Likeness 0.24

Literature References

PubMed DOI Target Context # Activities
17937986 10.1016/j.bmcl.2007.09.090 Dipeptidyl peptidase 4 1

Data from ChEMBL 36 via Core Engine