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

CHEMBL319676

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)COc1ccc(C(=O)CCl)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL319676
Phase Preclinical
Structure Type MOL
InChI Key NWSHRVVVVVDAFM-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

228.6
MW (Da)
1.57
ALogP
3
HBA
1
HBD
63.6
PSA (Ų)
0.61
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H9ClO4
MW 228.63
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -0.68

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
12372498 10.1016/s0960-894x(02)00681-9 Tyrosine-protein phosphatase non-receptor type 1 3

Data from ChEMBL 36 via Core Engine