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Compound Detail

CHEMBL132269

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Cc1cc(OCc2ccc(-c3ccccc3C(=O)O)cc2)c2ccccc2n1

Basic Information

ChEMBL ID CHEMBL132269
Phase Preclinical
Structure Type MOL
InChI Key CZHTVPAZYQJIGP-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

369.4
MW (Da)
5.49
ALogP
3
HBA
1
HBD
59.4
PSA (Ų)
0.51
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H19NO3
MW 369.42
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -0.56

Activity Summary

IC50 1 meas. best 6.75

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Type-1 angiotensin II receptor
CHEMBL1671613
IC50 6.75 6.75 180.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
1433210 10.1021/jm00100a007 Type-1 angiotensin II receptor 1

Data from ChEMBL 36 via Core Engine