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Compound Detail

CHEMBL3262901

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CCOC(=O)COc1cc2ccc(=O)oc2cc1OCC(=O)OCC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3262901
Phase Preclinical
Structure Type MOL
InChI Key UBWMUTZDGDINDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

350.3
MW (Da)
1.68
ALogP
8
HBA
0
HBD
101.3
PSA (Ų)
0.52
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H18O8
MW 350.32
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.05

Literature References

PubMed DOI Target Context # Activities
24681028 10.1016/j.ejmech.2014.03.029 NON-PROTEIN TARGET 2

Data from ChEMBL 36 via Core Engine