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

CHEMBL280677

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
NC(Cc1cc(F)ccc1CCP(=O)(O)O)C(=O)O

Basic Information

ChEMBL ID CHEMBL280677
Phase Preclinical
Structure Type MOL
InChI Key HHSLMAQWEYWIRH-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

291.2
MW (Da)
0.50
ALogP
3
HBA
4
HBD
120.8
PSA (Ų)
0.57
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H15FNO5P
MW 291.21
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness 0.17

Activity Summary

Ki 2 meas. best 4.17

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Rattus norvegicus
CHEMBL376
Ki 4.17 4.17 68000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Rattus norvegicus Ki = 68000.0 nM 4.17 Inhibition of kainic acid (KA)-induced currents in rat brain mRNA-injected xenop... -

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(00)80228-0 Rattus norvegicus 2

Data from ChEMBL 36 via Core Engine