methylprednisolone

Ligand id: 7088

Name: methylprednisolone

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Structure and Physico-chemical Properties

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 374.21
XLogP 1.52
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
Approved drug? Yes (FDA (1957))
WHO Essential Medicine WHO Model List of Essential Medicines (21st List, 2019). Access PDF version.
IUPAC Name
(6S,8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-17-(2-hydroxyacetyl)-6,10,13-trimethyl-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-one
International Nonproprietary Names
INN number INN
732 methylprednisolone
Synonyms
Medrol® | U-67590A
Comments
Methylprednisolone is a corticosteroid.
Marketed formulations may contain methylprednisolone acetate (PubChem CID 5877).
Methylprednisolone has been reported to activate the TRPC5 ion channel [2]. Methylprednisolone-induced activation of TRPC5 is long lasting, reversible and sensitive to the TRPC5 inhibitor clemizole [2].
Database Links
CAS Registry No. 83-43-2
ChEBI CHEBI:6888
ChEMBL Ligand CHEMBL650
DrugBank Ligand DB00959
GtoPdb PubChem SID 178103666
Immunopaedia Search methylprednisolone
NURSA Ligand 10.1621/6A7WO8R4WE
PubChem CID 6741
Search Google for chemical match using the InChIKey VHRSUDSXCMQTMA-PJHHCJLFSA-N
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Search UniChem for chemical match using the InChIKey VHRSUDSXCMQTMA-PJHHCJLFSA-N
Search UniChem for chemicals with the same backbone VHRSUDSXCMQTMA
Wikipedia Methylprednisolone

Product suppliers

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Tocris
Methylprednisolone
Cat. No. 4819