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

CHEMBL5192592

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
Cn1cc(-c2cnc3ccc(CCn4nc(-c5cc(F)c(F)c(F)c5)ccc4=O)cc3c2)cn1

Basic Information

ChEMBL ID CHEMBL5192592
Phase Preclinical
Structure Type MOL
InChI Key LLCDQTCPBRMEPQ-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

461.4
MW (Da)
4.52
ALogP
6
HBA
0
HBD
65.6
PSA (Ų)
0.36
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H18F3N5O
MW 461.45
Aromatic Rings 5
Heavy Atoms 34
NP-Likeness -1.93

Activity Summary

IC50 2 meas. best 8.12

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 8.12 8.12 7.6 1
Hs746T
CHEMBL614579
IC50 6.64 6.64 227.5 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
36355693 10.1021/acs.jmedchem.2c00981 Hepatocyte growth factor receptor 1
36355693 10.1021/acs.jmedchem.2c00981 Hs746T 1

Data from ChEMBL 36 via Core Engine