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Compound Detail

CHEMBL4089190

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CS(=O)(=O)c1nc(N=[N+]=[N-])cc(-c2cccs2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4089190
Phase Preclinical
Structure Type MOL
InChI Key SKGZKGPXBVJODU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

281.3
MW (Da)
2.55
ALogP
6
HBA
0
HBD
108.7
PSA (Ų)
0.37
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H7N5O2S2
MW 281.32
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -1.57

Literature References

PubMed DOI Target Context # Activities
28435527 10.1021/acsmedchemlett.6b00489 Succinate dehydrogenase [ubiquinone] iron-sulfur subunit, mitochondrial 1

Data from ChEMBL 36 via Core Engine