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

CHEMBL5992232

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
CC(C)N1CCOc2c(F)cc(-c3nc(Nc4ccc5c(c4)CC(N(C)C)C5)ncc3F)cc21

Basic Information

ChEMBL ID CHEMBL5992232
Phase Preclinical
Structure Type MOL
InChI Key BLBRCCGITKEOBW-UHFFFAOYSA-N
3
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

465.6
MW (Da)
4.80
ALogP
6
HBA
1
HBD
53.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H29F2N5O
MW 465.55
Aromatic Rings 3
Heavy Atoms 34
NP-Likeness -1.07

Activity Summary

IC50 3 meas. best 8.46

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Cyclin-dependent kinase 6
CHEMBL2508
IC50 8.46 8.46 3.5 1
Cyclin-dependent kinase 4
CHEMBL331
IC50 8.19 8.19 6.5 1
Macrophage colony-stimulating factor 1 receptor
CHEMBL1844
IC50 7.75 7.75 18.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine