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

CHEMBL45372

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
CCCCC[C@@H](O)/C=C/[C@@H]1CCC(=O)N1CCCCCCC(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL45372
Phase Preclinical
Structure Type MOL
InChI Key XOPMUDZOEKPBQZ-HZTRFMAJSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

339.5
MW (Da)
3.51
ALogP
3
HBA
2
HBD
77.8
PSA (Ų)
0.40
QED
0
Ro5 Violations
13
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H33NO4
MW 339.48
Aromatic Rings 0
Heavy Atoms 24
NP-Likeness 0.77

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
15026044 10.1016/j.bmcl.2004.01.063 Prostaglandin E2 receptor EP4 subtype 1

Data from ChEMBL 36 via Core Engine