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Compound Detail

CHEMBL592189

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CC(C)(C)c1nnc(Cc2cccc(C3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c2)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL592189
Phase Preclinical
Structure Type MOL
InChI Key RAIIYMQOHRWNKI-KYEPVHRCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

394.5
MW (Da)
0.94
ALogP
8
HBA
4
HBD
115.9
PSA (Ų)
0.61
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H26N2O5S
MW 394.49
Aromatic Rings 2
Heavy Atoms 27
NP-Likeness 0.43

Literature References

PubMed DOI Target Context # Activities
20181486 10.1016/j.bmc.2010.01.073 Sodium/glucose cotransporter 2 1

Data from ChEMBL 36 via Core Engine