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Compound Detail

CHEMBL169360

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NCCCC[C@H](N)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL169360
Phase Preclinical
Structure Type MOL
InChI Key RVKIPWVMZANZLI-ZFWWWQNUSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
0.74
ALogP
4
HBA
5
HBD
134.2
PSA (Ų)
0.43
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C17H24N4O3
MW 332.40
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.39

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16759105 10.1021/jm0511029 Solute carrier family 15 member 1 3
1347791 10.1021/jm00083a013 Aminopeptidase N 1
1347791 10.1021/jm00083a013 Aminopeptidase B 1
19060912 10.1038/nchembio.132 General amino-acid permease GAP1 1

Data from ChEMBL 36 via Core Engine