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

CHEMBL1089712

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)c1oc(-c2c3c(nc4sc(C(N)=O)c(N)c24)CCCCCC3)cc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1089712
Phase Preclinical
Structure Type MOL
InChI Key ZRQQPRIJTHNAKJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

413.5
MW (Da)
3.99
ALogP
7
HBA
2
HBD
121.4
PSA (Ų)
0.63
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 C21H23N3O4S
MW 413.50
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.00

Literature References

PubMed DOI Target Context # Activities
20189382 10.1016/j.bmcl.2010.02.005 Eukaryotic elongation factor 2 kinase 1

Data from ChEMBL 36 via Core Engine