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Compound Detail

CHEMBL111129

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CCCCCCCCC(P(=O)(OCC)OCC)P(=O)(OCC)OCC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL111129
Phase Preclinical
Structure Type MOL
InChI Key OJCDYDWXXYVJRK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

400.4
MW (Da)
6.60
ALogP
6
HBA
0
HBD
71.1
PSA (Ų)
0.20
QED
1
Ro5 Violations
17
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H38O6P2
MW 400.43
Aromatic Rings 0
Heavy Atoms 25
NP-Likeness 0.15

Literature References

PubMed DOI Target Context # Activities
12951099 10.1016/s0960-894x(03)00663-2 Trypanosoma cruzi 2

Data from ChEMBL 36 via Core Engine