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

CHEMBL79876

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
CCOC(=O)c1cnc2cc(OC)c(OC)cc2c1Nc1cc(OC)c(OC)c(OC)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL79876
Phase Preclinical
Structure Type MOL
InChI Key NSPRKBCGBIGEDX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

442.5
MW (Da)
4.20
ALogP
9
HBA
1
HBD
97.4
PSA (Ų)
0.49
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H26N2O7
MW 442.47
Aromatic Rings 3
Heavy Atoms 32
NP-Likeness -0.63

Literature References

PubMed DOI Target Context # Activities
11078204 10.1016/s0960-894x(00)00493-5 Proto-oncogene tyrosine-protein kinase Src 1

Data from ChEMBL 36 via Core Engine