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

CHEMBL204766

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)c1cc2c([nH]1)c(OC)cc1nc(-c3ccccc3)cc(O)c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL204766
Phase Preclinical
Structure Type MOL
InChI Key COZYLVXQETWOEC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
11
Publications
0
Known Names

Molecular Properties

348.4
MW (Da)
3.88
ALogP
5
HBA
2
HBD
84.4
PSA (Ų)
0.55
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 C20H16N2O4
MW 348.36
Aromatic Rings 4
Heavy Atoms 26
NP-Likeness -0.17

Literature References

PubMed DOI Target Context # Activities
16539377 10.1021/jm0510676 OVCAR-3 2
16539377 10.1021/jm0510676 HepG2 2
16539377 10.1021/jm0510676 MCF7 1
16539377 10.1021/jm0510676 ARO 1
16539377 10.1021/jm0510676 A549 1
16539377 10.1021/jm0510676 HT-29 1
16539377 10.1021/jm0510676 PT-45 1
16539377 10.1021/jm0510676 4T1 1
16539377 10.1021/jm0510676 BNL 1
16539377 10.1021/jm0510676 NCI-H295R 1
16539377 10.1021/jm0510676 HeLa 1

Data from ChEMBL 36 via Core Engine