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Compound Detail

CHEMBL375366

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CC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)O

Basic Information

ChEMBL ID CHEMBL375366
Phase Preclinical
Structure Type BOTH
InChI Key IJSCGKNXGRMPHS-FHWLQOOXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

441.5
MW (Da)
0.26
ALogP
5
HBA
4
HBD
144.5
PSA (Ų)
0.44
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H27N5O5
MW 441.49
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.40

Literature References

PubMed DOI Target Context # Activities
17358051 10.1021/jm0613469 Angiotensin II receptor (AT-1) type-1 1
17358051 10.1021/jm0613469 Type-2 angiotensin II receptor 1

Data from ChEMBL 36 via Core Engine