CORTIVAZOL

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Synonyms
Status
Molecule Category Free-form
ATC H02AB17
UNII YM183K0H63
EPA CompTox DTXSID40149442

Structure

InChI Key RKHQGWMMUURILY-UHRZLXHJSA-N
Smiles CC(=O)OCC(=O)[C@@]1(O)[C@H](C)C[C@H]2[C@@H]3C=C(C)C4=Cc5c(cnn5-c5ccccc5)C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C
InChI
InChI=1S/C32H38N2O5/c1-18-11-23-25-12-19(2)32(38,28(37)17-39-20(3)35)31(25,5)15-27(36)29(23)30(4)14-21-16-33-34(26(21)13-24(18)30)22-9-7-6-8-10-22/h6-11,13,16,19,23,25,27,29,36,38H,12,14-15,17H2,1-5H3/t19-,23+,25+,27+,29-,30+,31+,32+/m1/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C32H38N2O5
Molecular Weight 530.67
AlogP 4.3
Hydrogen Bond Acceptor 7.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 101.65
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 39.0

Pharmacology

Mechanism of Action Action Reference
Glucocorticoid receptor agonist AGONIST PubMed PubMed PubMed PubMed PubMed PubMed PubMed PubMed

Target Conservation

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

Cross References

Resources Reference
ChEBI 135820
ChEMBL CHEMBL2105842
DrugBank DB13003
DrugCentral 736
FDA SRS YM183K0H63
PubChem 66249
SureChEMBL SCHEMBL4875
ZINC ZINC000004215466
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