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

CHEMBL5205360

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
CN(C)c1ccc(NC(=O)c2noc3ccccc23)cc1

Basic Information

ChEMBL ID CHEMBL5205360
Phase Preclinical
Structure Type MOL
InChI Key AFVFBXTUFOBKBU-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

281.3
MW (Da)
3.15
ALogP
4
HBA
1
HBD
58.4
PSA (Ų)
0.80
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H15N3O2
MW 281.32
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.72

Activity Summary

IC50 1 meas. best 7.62

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hypoxia-inducible factor 1-alpha
CHEMBL4261
IC50 7.62 7.62 24.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36518694 10.1021/acsmedchemlett.2c00308 Unchecked 5
36518694 10.1021/acsmedchemlett.2c00308 Hypoxia-inducible factor 1-alpha 1
36518694 10.1021/acsmedchemlett.2c00308 HEK-293T 1
36518694 10.1021/acsmedchemlett.2c00308 Amine oxidase [flavin-containing] A 1

Data from ChEMBL 36 via Core Engine