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Compound Detail

CHEMBL5192165

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O=C(Nc1ccc2ccccc2c1)c1noc2ccccc12

Basic Information

ChEMBL ID CHEMBL5192165
Phase Preclinical
Structure Type MOL
InChI Key UNJBAUBRUCUYNQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

288.3
MW (Da)
4.23
ALogP
3
HBA
1
HBD
55.1
PSA (Ų)
0.60
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H12N2O2
MW 288.31
Aromatic Rings 4
Heavy Atoms 22
NP-Likeness -1.37

Activity Summary

IC50 1 meas. best 7.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hypoxia-inducible factor 1-alpha
CHEMBL4261
IC50 7.12 7.12 75.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36518694 10.1021/acsmedchemlett.2c00308 Hypoxia-inducible factor 1-alpha 1
36518694 10.1021/acsmedchemlett.2c00308 HEK-293T 1

Data from ChEMBL 36 via Core Engine