Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL175945

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
O=C(O)c1cc2ccc3c(c2c(-c2ccc4c(c2)OCO4)c1C(=O)O)OCO3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL175945
Phase Preclinical
Structure Type MOL
InChI Key CEAXLCFVBSPTRM-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
8
Publications
0
Known Names

Molecular Properties

380.3
MW (Da)
3.36
ALogP
6
HBA
2
HBD
111.5
PSA (Ų)
0.71
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H12O8
MW 380.31
Aromatic Rings 3
Heavy Atoms 28
NP-Likeness 0.52

Literature References

PubMed DOI Target Context # Activities
15658867 10.1021/jm034265a Unchecked 2
15658867 10.1021/jm034265a Hepatitis B virus 1
15658867 10.1021/jm034265a Hepatitis C virus 1
15658867 10.1021/jm034265a Human alphaherpesvirus 1 1
15658867 10.1021/jm034265a Human alphaherpesvirus 2 1
15658867 10.1021/jm034265a Human gammaherpesvirus 4 1
15658867 10.1021/jm034265a MT2 1
15658867 10.1021/jm034265a CCRF-CEM 1

Data from ChEMBL 36 via Core Engine