cortisol

Ligand Id: 2868
Ligand name cortisol

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 94.83
Molecular weight 362.21
XLogP 0.55
No. Lipinski's rules broken 0

Molecular properties generated using the CDK


Classification
Compound class Metabolite or derivative
Approved drug? Yes (source: FDA (1953, prior history unavailable))
IUPAC Name
(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13-dimethyl-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-3-one
International Nonproprietary Names
INN number INN
38 hydrocortisone
Synonyms
hydrocortisone
Database Links
BindingDB Ligand 22476
CAS Registry No. 50-23-7 (source: Scifinder)
ChEBI CHEBI:17650
ChEMBL Ligand CHEMBL389621
DrugBank Ligand DB00741
Human Metabolome Database HMDB00063
Lipid Maps LMST02030001
PubChem CID 5754
Search Google for chemical match using the InChIKey JYGXADMDTFJGBT-VWUMJDOOSA-N
Search Google for chemicals with the same backbone JYGXADMDTFJGBT
Search PubMed clinical trials hydrocortisone
Search PubMed titles hydrocortisone
Search PubMed titles/abstracts hydrocortisone
Wikipedia cortisol
ZINC ZINC13540519
Comments
Approved as hydrocortisone. This drug is a glucocorticoid receptor agonist.