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Compound Detail

CHEMBL1784984

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CCOC(=O)c1c(O)cccc1CCCCCCCCO
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1784984
Phase Preclinical
Structure Type MOL
InChI Key HNECLBVQVICJQX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

294.4
MW (Da)
3.44
ALogP
4
HBA
2
HBD
66.8
PSA (Ų)
0.51
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H26O4
MW 294.39
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness 0.47

Literature References

PubMed DOI Target Context # Activities
18789702 10.1016/j.bmc.2008.08.057 Glyceraldehyde-3-phosphate dehydrogenase, glycosomal 1

Data from ChEMBL 36 via Core Engine