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

CHEMBL288588

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=C(O)c1cccc(CSc2nnc(-c3ccncc3)o2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL288588
Phase Preclinical
Structure Type MOL
InChI Key YGJKMSYPNYBKEQ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

313.3
MW (Da)
3.12
ALogP
6
HBA
1
HBD
89.1
PSA (Ų)
0.72
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H11N3O3S
MW 313.34
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.83

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12031334 10.1016/s0960-894x(02)00169-5 Glycogen synthase kinase-3 beta 1

Data from ChEMBL 36 via Core Engine