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Compound Detail

CHEMBL4776673

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Cc1cccn1C(=S)SSC(=S)n1cccc1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4776673
Phase Preclinical
Structure Type MOL
InChI Key SRJLNUGVUCSPLT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

312.5
MW (Da)
4.25
ALogP
6
HBA
0
HBD
9.9
PSA (Ų)
0.53
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H12N2S4
MW 312.51
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.01

Literature References

PubMed DOI Target Context # Activities
32711108 10.1016/j.ejmech.2020.112500 Fructose-1,6-bisphosphatase 1 2

Data from ChEMBL 36 via Core Engine