FLUOCINONIDE

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Trade Names
Synonyms
Status
Molecule Category Free-form
ATC C05AA11 D07AC08
UNII 2W4A77YPAN
EPA CompTox DTXSID8045307

Structure

InChI Key WJOHZNCJWYWUJD-IUGZLZTKSA-N
Smiles CC(=O)OCC(=O)[C@@]12OC(C)(C)O[C@@H]1C[C@H]1[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@@]12C
InChI
InChI=1S/C26H32F2O7/c1-13(29)33-12-20(32)26-21(34-22(2,3)35-26)10-15-16-9-18(27)17-8-14(30)6-7-23(17,4)25(16,28)19(31)11-24(15,26)5/h6-8,15-16,18-19,21,31H,9-12H2,1-5H3/t15-,16-,18-,19-,21+,23-,24-,25-,26+/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C26H32F2O7
Molecular Weight 494.53
AlogP 2.94
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 99.13
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 35.0

Pharmacology

Mechanism of Action Action Reference
Glucocorticoid receptor agonist AGONIST PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Transporter Electrochemical transporter SLC superfamily of solute carriers SLC21/SLCO family of organic anion transporting polypeptides
- - - - 97.92-119.95
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Cricetulus griseus
- - - - 97.92-119.95

Target Conservation

Protein: Glucocorticoid receptor
Description: Glucocorticoid receptor
Organism : Homo sapiens
P04150 ENSG00000113580

Related Entries

Cross References

Resources Reference
ChEBI 5109
ChEMBL CHEMBL1501
DrugBank DB01047
DrugCentral 1205
FDA SRS 2W4A77YPAN
Human Metabolome Database HMDB0015181
Guide to Pharmacology 7078
PharmGKB PA449664
PubChem 9642
SureChEMBL SCHEMBL4262
ZINC ZINC000003977978
CONTENTS