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

CHEMBL3969667

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
COc1cccnc1C#CCN(c1ccc2ncc(-c3cnn(C)c3)nc2c1)c1c(Cl)c(OC)cc(OC)c1Cl

Basic Information

ChEMBL ID CHEMBL3969667
Phase Preclinical
Structure Type MOL
InChI Key PPFQKJGJQXSDJS-UHFFFAOYSA-N
5
Targets
8
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

575.5
MW (Da)
5.95
ALogP
9
HBA
0
HBD
87.4
PSA (Ų)
0.22
QED
2
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C29H24Cl2N6O3
MW 575.46
Aromatic Rings 5
Heavy Atoms 40
NP-Likeness -1.12

Activity Summary

IC50 8 meas. best 8.58

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Fibroblast growth factor receptor 1
CHEMBL3650
IC50 8.58 8.38 2.6 2
Fibroblast growth factor receptor 3
CHEMBL2742
IC50 8.23 8.035 5.9 2
Fibroblast growth factor receptor 2
CHEMBL4142
IC50 7.91 7.91 12.3 1
Fibroblast growth factor receptor 4
CHEMBL3973
IC50 7.45 7.45 35.5 1
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 7.11 6.085 77.6 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine