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

CHEMBL2089198

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)Cn1c(C(=O)O)cc2cc(O)c(O)cc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2089198
Phase Preclinical
Structure Type MOL
InChI Key XEIXHHBMKICCTC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

251.2
MW (Da)
0.84
ALogP
5
HBA
4
HBD
120.0
PSA (Ų)
0.60
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 C11H9NO6
MW 251.19
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.28

Literature References

PubMed DOI Target Context # Activities
24900508 10.1021/ml300076u G-protein coupled receptor 35 2

Data from ChEMBL 36 via Core Engine