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Compound Detail

CHEMBL568352

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CCCCCCCCCCCCCCCCCC(=O)OC[C@@H](O)COP(=O)(O)O[C@H]1CN[C@@H](C(=O)O)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL568352
Phase Preclinical
Structure Type MOL
InChI Key IQWNCAYPTZMTSA-WXFUMESZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

551.7
MW (Da)
5.10
ALogP
8
HBA
4
HBD
151.6
PSA (Ų)
0.07
QED
2
Ro5 Violations
24
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H50NO9P
MW 551.66
Aromatic Rings 0
Heavy Atoms 37
NP-Likeness 0.84

Literature References

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

Data from ChEMBL 36 via Core Engine