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

CHEMBL1288093

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
CCOC(=O)c1cccc(Nc2nc(N)n(C(=O)c3ccc(N(C)C)cc3)n2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1288093
Phase Preclinical
Structure Type MOL
InChI Key QHVZRSACWOIYKS-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

394.4
MW (Da)
2.54
ALogP
9
HBA
2
HBD
115.4
PSA (Ų)
0.61
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22N6O3
MW 394.44
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.43

Literature References

PubMed DOI Target Context # Activities
21106455 10.1016/j.bmcl.2010.10.026 Tyrosine-protein kinase JAK1 1
21106455 10.1016/j.bmcl.2010.10.026 Tyrosine-protein kinase JAK2 1
21106455 10.1016/j.bmcl.2010.10.026 Tyrosine-protein kinase JAK3 1
21106455 10.1016/j.bmcl.2010.10.026 Non-receptor tyrosine-protein kinase TYK2 1

Data from ChEMBL 36 via Core Engine