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Compound Detail

CHEMBL4567902

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C#CCN1Cc2ccc(Br)cc2C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4567902
Phase Preclinical
Structure Type MOL
InChI Key SVFQHRDVRHIUAC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

236.1
MW (Da)
2.40
ALogP
1
HBA
0
HBD
3.2
PSA (Ų)
0.68
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H10BrN
MW 236.11
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -1.48

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