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

CHEMBL5221024

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
N#Cc1c(N2CCOCC2)ncc2c(=O)c3ccccc3[nH]c12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5221024
Phase Preclinical
Structure Type MOL
InChI Key OHIJVRUINPQKTO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

306.3
MW (Da)
1.78
ALogP
5
HBA
1
HBD
82.0
PSA (Ų)
0.69
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H14N4O2
MW 306.33
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.10

Literature References

PubMed DOI Target Context # Activities
36208544 10.1016/j.bmc.2022.117043 SK-N-AS 1
36208544 10.1016/j.bmc.2022.117043 HT-1080 1
36208544 10.1016/j.bmc.2022.117043 SH-SY5Y 1

Data from ChEMBL 36 via Core Engine