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

CHEMBL5556133

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
CN(CCO)c1nc(N)c(C(=O)NC(=N)N)nc1-c1ccc(Br)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5556133
Phase Preclinical
Structure Type MOL
InChI Key JCDIEJNWCNNWMP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

408.3
MW (Da)
0.54
ALogP
7
HBA
5
HBD
154.2
PSA (Ų)
0.36
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H18BrN7O2
MW 408.26
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.73

Literature References

PubMed DOI Target Context # Activities
38246115 10.1016/j.bmc.2024.117603 Sodium/hydrogen exchanger 5 2
38246115 10.1016/j.bmc.2024.117603 Sodium/hydrogen exchanger 1 2

Data from ChEMBL 36 via Core Engine