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Compound Detail

CHEMBL1808394

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OC[C@H]1O[C@@H](c2ccc(Cl)c(Cc3ccc(CCOC4CC4)cc3)c2)[C@H](O)[C@@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1808394
Phase Preclinical
Structure Type MOL
InChI Key LQLLRLTVYLVSTP-SJSRKZJXSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

448.9
MW (Da)
2.17
ALogP
6
HBA
4
HBD
99.4
PSA (Ų)
0.49
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C24H29ClO6
MW 448.94
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness 0.94

Literature References

PubMed DOI Target Context # Activities
21737266 10.1016/j.bmcl.2011.06.032 Sodium/glucose cotransporter 2 1
21737266 10.1016/j.bmcl.2011.06.032 Sodium/glucose cotransporter 1 1
21737266 10.1016/j.bmcl.2011.06.032 Unchecked 1

Data from ChEMBL 36 via Core Engine