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Compound Detail

CHEMBL225470

10-METHOXYMETHYLOXY-GINKGOLIDE A
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COCO[C@H]1C(=O)O[C@H]2O[C@@]34OC(=O)[C@@H]5C[C@@H](C(C)(C)C)[C@@]21[C@]53C[C@@H]1OC(=O)[C@@H](C)[C@@]14O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL225470
Name 10-METHOXYMETHYLOXY-GINKGOLIDE A
Phase Preclinical
Structure Type MOL
InChI Key OBSYKXQVZZUSPC-RFISJDOASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

452.5
MW (Da)
0.49
ALogP
10
HBA
1
HBD
126.8
PSA (Ų)
0.37
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H28O10
MW 452.46
Aromatic Rings 0
Heavy Atoms 32
NP-Likeness 2.35

Literature References

PubMed DOI Target Context # Activities
17352465 10.1021/jm070003n Glycine receptor subunit alpha-1 2
17352465 10.1021/jm070003n Glycine receptor subunit alpha-2 1

Data from ChEMBL 36 via Core Engine