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Compound Detail

CHEMBL421768

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O=P(O)(O)O[C@@H]1O[C@H](O)[C@@H](O)[C@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL421768
Phase Preclinical
Structure Type MOL
InChI Key VRFAWQKWVNQYPE-YCAKELIYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

216.1
MW (Da)
-2.51
ALogP
6
HBA
5
HBD
136.7
PSA (Ų)
0.32
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C4H9O8P
MW 216.08
Aromatic Rings 0
Heavy Atoms 13
NP-Likeness 2.21

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12383012 10.1021/jm020224n Unchecked 1

Data from ChEMBL 36 via Core Engine