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Compound Detail

CHEMBL1209029

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O=S(=O)([O-])OCCC[S@+]1C[C@@H](O)[C@H](O)[C@H]1CO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1209029
Phase Preclinical
Structure Type MOL
InChI Key WUDSIPAKGUJAHB-OSBXHZLRSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

288.3
MW (Da)
-2.43
ALogP
7
HBA
3
HBD
127.1
PSA (Ų)
0.21
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H16O7S2
MW 288.34
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 1.59

Literature References

PubMed DOI Target Context # Activities
20598536 10.1016/j.bmcl.2010.06.059 Unchecked 1

Data from ChEMBL 36 via Core Engine