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Compound Detail

CHEMBL4105658

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CCOP(=O)(OCC)C(CO)CCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4105658
Phase Preclinical
Structure Type MOL
InChI Key WDEDQBGGFKXLQY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

286.3
MW (Da)
3.25
ALogP
4
HBA
1
HBD
55.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H23O4P
MW 286.31
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness 0.14

Literature References

PubMed DOI Target Context # Activities
28445786 10.1016/j.ejmech.2017.04.035 Unchecked 1
28445786 10.1016/j.ejmech.2017.04.035 GIM-1 protein 1
28445786 10.1016/j.ejmech.2017.04.035 Beta-lactamase VIM-2 1

Data from ChEMBL 36 via Core Engine