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Compound Detail

CHEMBL420515

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CCCCc1ncc(-c2ccccc2C(=O)O)n1Cc1ccccc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL420515
Phase Preclinical
Structure Type MOL
InChI Key FQDCWCDFUBKYFP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

368.9
MW (Da)
5.29
ALogP
3
HBA
1
HBD
55.1
PSA (Ų)
0.62
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H21ClN2O2
MW 368.86
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.18

Literature References

PubMed DOI Target Context # Activities
1433195 10.1021/jm00099a013 Angiotensin II receptor 2

Data from ChEMBL 36 via Core Engine