CLOCORTOLONE PIVALATE

/static/temp/default.svg Search structure
Trade Names
Synonyms
Status
Molecule Category Free-form
UNII QBL8IZH14X
EPA CompTox DTXSID0045460

Structure

InChI Key SXYZQZLHAIHKKY-GSTUPEFVSA-N
Smiles C[C@@H]1C[C@H]2[C@@H]3C[C@H](F)C4=CC(=O)C=C[C@]4(C)[C@@]3(Cl)[C@@H](O)C[C@]2(C)[C@H]1C(=O)COC(=O)C(C)(C)C
InChI
InChI=1S/C27H36ClFO5/c1-14-9-16-17-11-19(29)18-10-15(30)7-8-26(18,6)27(17,28)21(32)12-25(16,5)22(14)20(31)13-34-23(33)24(2,3)4/h7-8,10,14,16-17,19,21-22,32H,9,11-13H2,1-6H3/t14-,16+,17+,19+,21+,22-,25+,26+,27+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C27H36ClFO5
Molecular Weight 495.03
AlogP 4.6
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 3.0
Polar Surface Area 80.67
Molecular species NEUTRAL
Aromatic Rings 0.0
Heavy Atoms 34.0

Pharmacology

Mechanism of Action Action Reference
Glucocorticoid receptor agonist AGONIST Wikipedia FDA

Target Conservation

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

Cross References

Resources Reference
ChEBI 59583
ChEMBL CHEMBL1200975
DrugCentral 4606
FDA SRS QBL8IZH14X
PharmGKB PA164744013
PubChem 5282493
SureChEMBL SCHEMBL5120
ZINC ZINC000004212603
CONTENTS