Structure

InChI Key XQSPYNMVSIKCOC-UHFFFAOYSA-N
Smile Nc1nc(=O)n(C2CSC(CO)O2)cc1F
InChI
InChI=1S/C8H10FN3O3S/c9-4-1-12(8(14)11-7(4)10)5-3-16-6(2-13)15-5/h1,5-6,13H,2-3H2,(H2,10,11,14)

Physicochemical Descriptors

Property Name Value
Molecular Formula C8H10FN3O3S
Molecular Weight 247.25
AlogP -0.46
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 2.0
Polar Surface Area 90.37
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 16.0

Indications

Mesh Heading Maximum Phase Mesh ID Reference
HIV Infections 2 D015658 ClinicalTrials

Related Entries

Scaffolds

Cross References

Resources Reference
ChEMBL CHEMBL161381
FDA SRS ULS8902U4O
PubChem 9837769
SureChEMBL SCHEMBL122131