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Compound Detail

CHEMBL316567

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COC(=O)C1=C(c2ccccc2)c2c(OC)cccc2C1=O

Basic Information

ChEMBL ID CHEMBL316567
Phase Preclinical
Structure Type MOL
InChI Key QWWAGFSYBAFLFG-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

294.3
MW (Da)
2.87
ALogP
4
HBA
0
HBD
52.6
PSA (Ų)
0.64
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H14O4
MW 294.31
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness 0.22

Activity Summary

IC50 2 meas. best 4.89

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Proto-oncogene tyrosine-protein kinase Src
CHEMBL267
IC50 4.89 4.89 13000.0 1
Fibroblast growth factor receptor
CHEMBL2095217
IC50 4.82 4.82 15000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(97)10110-X Fibroblast growth factor receptor 1
- 10.1016/S0960-894X(97)10110-X Platelet-derived growth factor receptor 1
- 10.1016/S0960-894X(97)10110-X Proto-oncogene tyrosine-protein kinase Src 1

Data from ChEMBL 36 via Core Engine