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Compound Detail

CHEMBL5266980

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COc1cc(O)c2c(=O)c3c(O)c(O[C@H]4O[C@@H](CO)[C@H](O)[C@H](O)[C@@H]4O)ccc3oc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5266980
Phase Preclinical
Structure Type MOL
InChI Key RQMZXBPFTUGCLL-NNOUCZNASA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

436.4
MW (Da)
-0.46
ALogP
11
HBA
6
HBD
179.3
PSA (Ų)
0.29
QED
2
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H20O11
MW 436.37
Aromatic Rings 3
Heavy Atoms 31
NP-Likeness 2.03

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
30282319 10.1016/j.ejmech.2018.07.073 Maltase-glucoamylase 2

Data from ChEMBL 36 via Core Engine