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

CHEMBL5505914

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=C1Nc2ccc(NC(=O)c3ncco3)cc2/C1=C/c1cnc[nH]1

Basic Information

ChEMBL ID CHEMBL5505914
Phase Preclinical
Structure Type MOL
InChI Key MKPVSBXNUZHNAN-SDQBBNPISA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

321.3
MW (Da)
2.14
ALogP
5
HBA
3
HBD
112.9
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H11N5O3
MW 321.30
Aromatic Rings 3
Heavy Atoms 24
NP-Likeness -0.87

Activity Summary

IC50 1 meas. best 7.82

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Serine/threonine-protein kinase tousled-like 2
CHEMBL5404
IC50 7.82 7.82 15.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
38636130 10.1016/j.ejmech.2024.116357 Serine/threonine-protein kinase tousled-like 2 1
38636130 10.1016/j.ejmech.2024.116357 Receptor-type tyrosine-protein kinase FLT3 1
38636130 10.1016/j.ejmech.2024.116357 NT-3 growth factor receptor 1
38636130 10.1016/j.ejmech.2024.116357 Serine/threonine-protein kinase tousled-like 1 1

Data from ChEMBL 36 via Core Engine