Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL302840

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(O)CCC(=O)N1CCCC1C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL302840
Phase Preclinical
Structure Type MOL
InChI Key NEBOPDYAXPDYHQ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

215.2
MW (Da)
-0.07
ALogP
3
HBA
2
HBD
94.9
PSA (Ų)
0.68
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H13NO5
MW 215.21
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness -0.46

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
8340909 10.1021/jm00067a001 Angiotensin-converting enzyme 1
8459398 10.1021/jm00058a006 Angiotensin-converting enzyme 1

Data from ChEMBL 36 via Core Engine