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Compound Detail

CHEMBL125345

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O=C([O-])c1ccc(-c2ccccn2)nc1.[K+]

Basic Information

ChEMBL ID CHEMBL125345
Phase Preclinical
Structure Type MOL
InChI Key WNPCDCLCWAAEPZ-UHFFFAOYSA-M
Parent Compound CHEMBL1205641
Active Moiety CHEMBL1205641

Known Names

Potassium [2,2']Bipyridinyl-5-Carboxylate
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
1
Known Names

Molecular Properties

200.2
MW (Da)
1.84
ALogP
3
HBA
1
HBD
63.1
PSA (Ų)
0.80
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H7KN2O2
MW 238.29
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -1.04

Activity Summary

IC50 1 meas. best 4.88

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Transmembrane prolyl 4-hydroxylase
CHEMBL3047
IC50 4.88 4.88 13200.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
8254616 10.1021/jm00076a014 Transmembrane prolyl 4-hydroxylase 1

Data from ChEMBL 36 via Core Engine