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Compound Detail

CHEMBL159330

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CN(CC(=O)O)C(=O)C1CCCCC1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL159330
Phase Preclinical
Structure Type MOL
InChI Key ZOXFKVOHKJJSSB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

243.3
MW (Da)
0.42
ALogP
3
HBA
2
HBD
94.9
PSA (Ų)
0.75
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 C11H17NO5
MW 243.26
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness -0.33

Literature References

PubMed DOI Target Context # Activities
8459398 10.1021/jm00058a006 Angiotensin-converting enzyme 1

Data from ChEMBL 36 via Core Engine