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Compound Detail

CHEMBL59411

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O=C(O)CC(O)CC(O)CCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL59411
Phase Preclinical
Structure Type MOL
InChI Key RHVDBYDDYIUVKS-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

238.3
MW (Da)
1.21
ALogP
3
HBA
3
HBD
77.8
PSA (Ų)
0.67
QED
0
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H18O4
MW 238.28
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 1.04

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
2909732 10.1021/jm00121a036 3-hydroxy-3-methylglutaryl-coenzyme A reductase 1

Data from ChEMBL 36 via Core Engine