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Compound Detail

CHEMBL4535203

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CCCN1C(=O)/C(=C\c2ccc(-c3ccc(Cl)cc3)o2)NC1=S
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4535203
Phase Preclinical
Structure Type MOL
InChI Key AZLNHNIBTRWSMB-GXDHUFHOSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

346.8
MW (Da)
4.07
ALogP
3
HBA
1
HBD
45.5
PSA (Ų)
0.67
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H15ClN2O2S
MW 346.84
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.52

Literature References

PubMed DOI Target Context # Activities
30925338 10.1016/j.ejmech.2019.03.039 Glycogen synthase kinase-3 alpha 2
30925338 10.1016/j.ejmech.2019.03.039 Glycogen synthase kinase-3 beta 2

Data from ChEMBL 36 via Core Engine