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Compound Detail

CHEMBL182853

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COc1cc(C(O)C2CCCC3=CC(=O)CCC32C)cc(OC)c1OC
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL182853
Phase Preclinical
Structure Type MOL
InChI Key WMYJJHVDABWXST-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

360.4
MW (Da)
3.84
ALogP
5
HBA
1
HBD
65.0
PSA (Ų)
0.86
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H28O5
MW 360.45
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 1.35

Literature References

PubMed DOI Target Context # Activities
15380227 10.1016/j.bmcl.2004.07.052 Glucocorticoid receptor 3

Data from ChEMBL 36 via Core Engine