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

CHEMBL205283

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
COC(=O)c1cn2ncnc(Oc3ccc4[nH]c(C)cc4c3)c2c1C

Basic Information

ChEMBL ID CHEMBL205283
Phase Preclinical
Structure Type MOL
InChI Key GUDPPZNLSBORFZ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

336.4
MW (Da)
3.41
ALogP
6
HBA
1
HBD
81.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H16N4O3
MW 336.35
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -1.16

Activity Summary

IC50 1 meas. best 7.11

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vascular endothelial growth factor receptor 2
CHEMBL279
IC50 7.11 7.11 78.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Vascular endothelial growth factor receptor 2 IC50 = 78.0 nM 7.11 Inhibitory activity against VEGFR2 16570908

Literature References

PubMed DOI Target Context # Activities
16570908 10.1021/jm051106d Vascular endothelial growth factor receptor 2 1

Data from ChEMBL 36 via Core Engine