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Compound Detail

CHEMBL148654

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O=P(O)(O)C(O)c1ccc(C(O)P(=O)(O)O)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL148654
Phase Preclinical
Structure Type MOL
InChI Key UNLBCEYNZBFTNI-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

298.1
MW (Da)
0.02
ALogP
4
HBA
6
HBD
155.5
PSA (Ų)
0.42
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H12O8P2
MW 298.12
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness 0.33

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
9871609 10.1016/s0960-894x(98)00059-6 Phosphoglycerate kinase 1

Data from ChEMBL 36 via Core Engine