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Compound Detail

CHEMBL177870

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O=C(NC(Cc1ccccc1)C(=O)CCC(=O)N1CCCC1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL177870
Phase Preclinical
Structure Type MOL
InChI Key QYHUTQXOVWGOEV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

378.5
MW (Da)
3.00
ALogP
3
HBA
1
HBD
66.5
PSA (Ų)
0.77
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N2O3
MW 378.47
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.66

Literature References

PubMed DOI Target Context # Activities
6173481 10.1021/jm00140a010 Angiotensin-converting enzyme 1

Data from ChEMBL 36 via Core Engine