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

CHEMBL1084938

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
Cc1ccc2c(c1)/C(=C1/Nc3ccccc3C1=O)C(=O)N2

Basic Information

ChEMBL ID CHEMBL1084938
Phase Preclinical
Structure Type MOL
InChI Key WXFDRTZMBRMEOV-PFONDFGASA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

276.3
MW (Da)
2.97
ALogP
3
HBA
2
HBD
58.2
PSA (Ų)
0.73
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H12N2O2
MW 276.30
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness 0.19

Activity Summary

EC50 1 meas. best 4.51

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
HT-22
CHEMBL614316
EC50 4.51 4.51 30800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
HT-22 EC50 = 30800.0 nM 4.51 Cytoprotective activity against tunicamycin-induced cell death in mouse HT22 cel... 29122482

Literature References

PubMed DOI Target Context # Activities
29122482 10.1016/j.bmcl.2017.10.069 HT-22 7
27106709 10.1016/j.bmcl.2016.03.111 Serine/threonine-protein kinase 17B 1

Data from ChEMBL 36 via Core Engine