clobetasone   Click here for help

GtoPdb Ligand ID: 9088

Synonyms: Eumovate®
Approved drug Immunopharmacology Ligand
clobetasone is an approved drug (UK (1999))
Compound class: Synthetic organic
Comment: Clobetasone is a corticosteroid used in dermatology.
2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 71.44
Molecular weight 408.15
XLogP 1.38
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
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Canonical SMILES ClCC(=O)C1(O)C(C)CC2C1(C)CC(=O)C1(C2CCC2=CC(=O)C=CC12C)F
Isomeric SMILES ClCC(=O)[C@@]1(O)[C@@H](C)C[C@@H]2[C@]1(C)CC(=O)[C@]1([C@H]2CCC2=CC(=O)C=C[C@]12C)F
InChI InChI=1S/C22H26ClFO4/c1-12-8-16-15-5-4-13-9-14(25)6-7-19(13,2)21(15,24)17(26)10-20(16,3)22(12,28)18(27)11-23/h6-7,9,12,15-16,28H,4-5,8,10-11H2,1-3H3/t12-,15-,16-,19-,20-,21-,22-/m0/s1
InChI Key XXIFVOHLGBURIG-OZCCCYNHSA-N
Immunopharmacology Comments
Clobetasone is a cortocosteroid used for its anti-inflammatory action.
Immunopharmacology Disease
Disease X-Refs Comment References
Dermatitis Disease Ontology: DOID:2723
Approved drug for atopic, irritant or allergic contact and seborrhoeic dermatitis.
Otitis externa Disease Ontology: DOID:9463
Approved drug for otitis externa.