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Compound Detail

CHEMBL482194

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N[C@@H]1CCN(C(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(-c3ccccc3)cc2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL482194
Phase Preclinical
Structure Type MOL
InChI Key ZIMSQSWLTQZZMV-TZIWHRDSSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

413.5
MW (Da)
2.46
ALogP
4
HBA
1
HBD
83.7
PSA (Ų)
0.83
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H27N3O3S
MW 413.54
Aromatic Rings 2
Heavy Atoms 29
NP-Likeness -1.37

Literature References

PubMed DOI Target Context # Activities
19128969 10.1016/j.bmcl.2008.12.042 Growth hormone secretagogue receptor type 1 1

Data from ChEMBL 36 via Core Engine