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

CHEMBL3260969

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
CCn1cnc(-c2cc3nccc(Oc4ccc(NC(=S)N5CCN(c6ccc(F)cc6)C5=O)cc4F)c3s2)c1

Basic Information

ChEMBL ID CHEMBL3260969
Phase Preclinical
Structure Type MOL
InChI Key WWJYHVSOOPPZAQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

576.6
MW (Da)
6.89
ALogP
7
HBA
1
HBD
75.5
PSA (Ų)
0.22
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C28H22F2N6O2S2
MW 576.65
Aromatic Rings 5
Heavy Atoms 40
NP-Likeness -1.75

Activity Summary

IC50 1 meas. best 7.57

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
IC50 7.57 7.57 27.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Hepatocyte growth factor receptor IC50 = 27.0 nM 7.57 Inhibition of c-Met (unknown origin) 24792774

Literature References

PubMed DOI Target Context # Activities
24792774 10.1016/j.ejmech.2014.04.056 Hepatocyte growth factor receptor 1

Data from ChEMBL 36 via Core Engine