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

CHEMBL2385694

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)c1cc(-c2ccc(Oc3ccccc3)cc2)nc2ccc(OC(F)(F)F)cc12

Basic Information

ChEMBL ID CHEMBL2385694
Phase Preclinical
Structure Type MOL
InChI Key OJEKTRFECKNJAA-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

425.4
MW (Da)
6.29
ALogP
4
HBA
1
HBD
68.7
PSA (Ų)
0.41
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H14F3NO4
MW 425.36
Aromatic Rings 4
Heavy Atoms 31
NP-Likeness -0.87

Activity Summary

EC50 1 meas. best 4.02

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vesicular stomatitis virus
CHEMBL613739
EC50 4.02 4.02 95600.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23930152 10.1021/ml300464h Vesicular stomatitis virus 1

Data from ChEMBL 36 via Core Engine