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Compound Detail

CHEMBL71545

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O=C(O)c1cccc2nc(N3CCCCC3)n(Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL71545
Phase Preclinical
Structure Type MOL
InChI Key JPVMNGNDKFHLJP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

479.5
MW (Da)
4.62
ALogP
7
HBA
2
HBD
112.8
PSA (Ų)
0.37
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H25N7O2
MW 479.54
Aromatic Rings 5
Heavy Atoms 36
NP-Likeness -1.13

Literature References

PubMed DOI Target Context # Activities
8340921 10.1021/jm00067a016 Type-1 angiotensin II receptor 1

Data from ChEMBL 36 via Core Engine