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

CHEMBL132876

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
O=C1c2ccccc2C(=O)c2c1oc1cc3c(cc21)OCO3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL132876
Phase Preclinical
Structure Type MOL
InChI Key JXNVSTHSEHIOAQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

292.2
MW (Da)
2.94
ALogP
5
HBA
0
HBD
65.7
PSA (Ų)
0.50
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H8O5
MW 292.25
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness 0.76

Literature References

PubMed DOI Target Context # Activities
8258835 10.1021/jm00077a016 HL-60 1
8258835 10.1021/jm00077a016 N592 1
8258835 10.1021/jm00077a016 NON-PROTEIN TARGET 1
8258835 10.1021/jm00077a016 Tumor Cell line 1
8258835 10.1021/jm00077a016 DNA topoisomerase 2-beta 1

Data from ChEMBL 36 via Core Engine