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Compound Detail

CHEMBL1160111

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O=S(=O)(O)OC[C@H]1OCC[C@@H](OCCCOc2ccccc2)C1OS(=O)(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1160111
Phase Preclinical
Structure Type MOL
InChI Key XZWBNIPEZFAKRG-GRKKQISMSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

442.5
MW (Da)
0.64
ALogP
9
HBA
2
HBD
154.9
PSA (Ų)
0.37
QED
0
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H22O11S2
MW 442.46
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness 0.71

Activity Summary

Kd 2 meas.

Literature References

PubMed DOI Target Context # Activities
15027859 10.1021/jm030447t Fibroblast growth factor 1 2
15027859 10.1021/jm030447t Fibroblast growth factor 2 2

Data from ChEMBL 36 via Core Engine