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Compound Detail

CHEMBL1801618

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O=C(CO)c1ccc(Br)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1801618
Phase Preclinical
Structure Type MOL
InChI Key FGROGLJVXNYNQC-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

215.1
MW (Da)
1.62
ALogP
2
HBA
1
HBD
37.3
PSA (Ų)
0.76
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H7BrO2
MW 215.05
Aromatic Rings 1
Heavy Atoms 11
NP-Likeness -0.01

Literature References

PubMed DOI Target Context # Activities
21500862 10.1021/jm1016279 Glycogen synthase kinase-3 beta 1

Data from ChEMBL 36 via Core Engine