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

CHEMBL7866

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
COC(=O)Cn1cc(-c2cccc(Cl)c2)c(=O)c2c(O)cc(OC)cc21

Basic Information

ChEMBL ID CHEMBL7866
Phase Preclinical
Structure Type MOL
InChI Key CXCSYLLGUQWHHQ-UHFFFAOYSA-N
2
Targets
3
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

373.8
MW (Da)
3.21
ALogP
6
HBA
1
HBD
77.8
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H16ClNO5
MW 373.79
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -0.27

Activity Summary

IC50 3 meas. best 7.19

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Epidermal growth factor receptor
CHEMBL203
IC50 7.19 6.045 64.0 2
Epidermal growth factor receptor
CHEMBL3608
IC50 5.02 5.02 9550.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
10090785 10.1021/jm980551o Epidermal growth factor receptor 3
10090785 10.1021/jm980551o Tyrosine-protein kinase ABL 1
10090785 10.1021/jm980551o Proto-oncogene tyrosine-protein kinase Src 1
10090785 10.1021/jm980551o Protein kinase C alpha type 1
10090785 10.1021/jm980551o Platelet-derived growth factor receptor 1

Data from ChEMBL 36 via Core Engine