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Compound Detail

CHEMBL2018083

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OC[C@H]1O[C@@H](c2cccc(Cc3cnccn3)c2)[C@H](O)[C@@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2018083
Phase Preclinical
Structure Type MOL
InChI Key ILFZRYWKCLJIMC-UUAJXVIYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

332.4
MW (Da)
-0.42
ALogP
7
HBA
4
HBD
115.9
PSA (Ų)
0.60
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 C17H20N2O5
MW 332.36
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 1.00

Literature References

PubMed DOI Target Context # Activities
22507206 10.1016/j.bmc.2012.03.051 Sodium/glucose cotransporter 2 1

Data from ChEMBL 36 via Core Engine