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Compound Detail

CHEMBL566249

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CCCCCCCCCCCCCCCCCC(=O)CCCCCOP(=O)(O)OC[C@H](N)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL566249
Phase Preclinical
Structure Type MOL
InChI Key HWQDOHWUXYORAG-VWLOTQADSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

521.7
MW (Da)
6.92
ALogP
6
HBA
3
HBD
136.2
PSA (Ų)
0.08
QED
2
Ro5 Violations
27
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H52NO7P
MW 521.68
Aromatic Rings 0
Heavy Atoms 35
NP-Likeness 0.72

Literature References

PubMed DOI Target Context # Activities
19743861 10.1021/jm900598m Mast cell 4

Data from ChEMBL 36 via Core Engine