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Compound Detail

CHEMBL434649

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CCCCCCCC(=O)OC[C@H](NC(=O)[C@H](CO)NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL434649
Phase Preclinical
Structure Type BOTH
InChI Key OXVFZMXYRUVGQR-ACRUOGEOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

506.6
MW (Da)
0.08
ALogP
7
HBA
5
HBD
176.9
PSA (Ų)
0.15
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Protein
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H38N4O7
MW 506.60
Aromatic Rings 1
Heavy Atoms 36
NP-Likeness 0.21

Literature References

PubMed DOI Target Context # Activities
11087562 10.1021/jm0001727 HEK293 2
11087562 10.1021/jm0001727 Growth hormone secretagogue receptor type 1 1

Data from ChEMBL 36 via Core Engine