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Compound Detail

CHEMBL327763

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O=P(O)(O)C(CCc1ccccn1)P(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL327763
Phase Preclinical
Structure Type MOL
InChI Key NWUAQBVTDOZYEH-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

281.1
MW (Da)
0.70
ALogP
3
HBA
4
HBD
128.0
PSA (Ų)
0.58
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H13NO6P2
MW 281.14
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness -0.66

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12086477 10.1021/jm010279+ Dictyostelium discoideum 1

Data from ChEMBL 36 via Core Engine