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

CHEMBL5812329

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
C=CCOc1ccc2c(C(F)(F)F)cc(=O)oc2c1

Basic Information

ChEMBL ID CHEMBL5812329
Phase Preclinical
Structure Type MOL
InChI Key MYYPDPXGAXJPTP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

270.2
MW (Da)
3.38
ALogP
3
HBA
0
HBD
39.4
PSA (Ų)
0.63
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H9F3O3
MW 270.21
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -0.55

Activity Summary

Kd 1 meas. best 8.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Advanced glycosylation end product-specific receptor
CHEMBL2176846
Kd 8.19 8.19 6.5 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine