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Compound Detail

CHEMBL565756

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Cc1ccc2c(c1)sc(=N)n2CCO

Basic Information

ChEMBL ID CHEMBL565756
Phase Preclinical
Structure Type MOL
InChI Key ZYEGBHHNJNZJHT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

208.3
MW (Da)
1.48
ALogP
4
HBA
2
HBD
49.0
PSA (Ų)
0.77
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 C10H12N2OS
MW 208.29
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -1.48

Literature References

PubMed DOI Target Context # Activities
19502068 10.1016/j.bmc.2009.05.039 Radical scavenging activity 1

Data from ChEMBL 36 via Core Engine