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

CHEMBL4547121

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
C#CCN(Cc1ccc(Br)cc1)C(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4547121
Phase Preclinical
Structure Type MOL
InChI Key MSTQIMXHUGEUJI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

266.1
MW (Da)
2.43
ALogP
1
HBA
0
HBD
20.3
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12BrNO
MW 266.14
Aromatic Rings 1
Heavy Atoms 15
NP-Likeness -1.62

Literature References

PubMed DOI Target Context # Activities
31362921 10.1016/j.bmcl.2019.07.047 Pyrroline-5-carboxylate reductase 1, mitochondrial 1

Data from ChEMBL 36 via Core Engine