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Compound Detail

CHEMBL3764911

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COc1cc(OC)cc(C2=NO[C@@]3(C2)O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)c1

Basic Information

ChEMBL ID CHEMBL3764911
Phase Preclinical
Structure Type MOL
InChI Key WFOMIPBJAVASTI-IBEHDNSVSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

355.3
MW (Da)
-1.00
ALogP
9
HBA
4
HBD
130.2
PSA (Ų)
0.54
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 C16H21NO8
MW 355.34
Aromatic Rings 1
Heavy Atoms 25
NP-Likeness 1.41

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
26708111 10.1016/j.ejmech.2015.12.004 Glycogen phosphorylase, liver form 3
26708111 10.1016/j.ejmech.2015.12.004 Glycogen phosphorylase, muscle form 1

Data from ChEMBL 36 via Core Engine