tizanidine   Click here for help

GtoPdb Ligand ID: 7308

Synonyms: AN-021 | DS-103-282 | Zanaflex®
Approved drug
tizanidine is an approved drug (FDA (1996))
Compound class: Synthetic organic
Comment: Tizanidine is a centrally acting α2-adrenoceptor agonist.
Marketed formulations may contain tizanidine hydrochloride (PubChem CID 114869).
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 90.44
Molecular weight 253.02
XLogP 2.25
No. Lipinski's rules broken 0
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Canonical SMILES Clc1ccc2c(c1NC1=NCCN1)nsn2
Isomeric SMILES Clc1ccc2c(c1NC1=NCCN1)nsn2
InChI InChI=1S/C9H8ClN5S/c10-5-1-2-6-8(15-16-14-6)7(5)13-9-11-3-4-12-9/h1-2H,3-4H2,(H2,11,12,13)
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes (FDA (1996))
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
4697 tizanidine
Synonyms Click here for help
AN-021 | DS-103-282 | Zanaflex®
Database Links Click here for help
Specialist databases
GPCRdb Ligand tizanidine
Other databases
CAS Registry No. 51322-75-9
ChEMBL Ligand CHEMBL1079
DrugBank Ligand DB00697
DrugCentral Ligand 2683
GtoPdb PubChem SID 178103881
PubChem CID 5487
Search Google for chemical match using the InChIKey XFYDIVBRZNQMJC-UHFFFAOYSA-N
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UniChem Compound Search for chemical match using the InChIKey XFYDIVBRZNQMJC-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey XFYDIVBRZNQMJC-UHFFFAOYSA-N
Wikipedia Tizanidine