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

CHEMBL3220255

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
OCc1ccc(-c2nn(Cc3ccc(Cl)cc3)c3ccccc23)o1

Basic Information

ChEMBL ID CHEMBL3220255
Phase Preclinical
Structure Type MOL
InChI Key RZYVNQLSJGXTCU-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

338.8
MW (Da)
4.49
ALogP
4
HBA
1
HBD
51.2
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H15ClN2O2
MW 338.79
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -1.12

Activity Summary

IC50 1 meas. best 5.55

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.55 5.55 2800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked IC50 = 2800.0 nM 5.55 Inhibition of HIF-1 (unknown origin) expressed in human HeLa cells after 12 hrs ... -

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C2MD20134H Unchecked 1

Data from ChEMBL 36 via Core Engine