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

CHEMBL4556656

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)[C@@H](O)CO

Basic Information

ChEMBL ID CHEMBL4556656
Phase Preclinical
Structure Type MOL
InChI Key RBNPOMFGQQGHHO-REOHCLBHSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

106.1
MW (Da)
-1.58
ALogP
3
HBA
3
HBD
77.8
PSA (Ų)
0.40
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C3H6O4
MW 106.08
Aromatic Rings 0
Heavy Atoms 7
NP-Likeness 1.92

Activity Summary

EC50 1 meas. best 8.72

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Olfactory receptor 51E2
CHEMBL4523454
EC50 8.72 8.72 1.9 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Olfactory receptor 51E2 EC50 = 1.9 nM 8.72 Agonist activity at PSGR/OR51E2 (unknown origin) expressed in human Hana3A cells... -

Data from ChEMBL 36 via Core Engine