dosulepin   Click here for help

GtoPdb Ligand ID: 7549

Synonyms: Dothep® | dothiepin | Prothiaden®
Approved drug
dosulepin is an approved drug
Compound class: Synthetic organic
Comment: Dosulepin is a tricyclic antidepressant. Functionally it acts as a serotonin-norepinephrine reuptake inhibitor (SNRI) with anticholinergic, antihistamine, and antiadrenergic effects.
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 28.54
Molecular weight 295.14
XLogP 4.56
No. Lipinski's rules broken 0
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Canonical SMILES CN(CCC=C1c2ccccc2SCc2c1cccc2)C
Isomeric SMILES CN(CC/C=C/1\c2ccccc2SCc2c1cccc2)C
InChI InChI=1S/C19H21NS/c1-20(2)13-7-11-17-16-9-4-3-8-15(16)14-21-19-12-6-5-10-18(17)19/h3-6,8-12H,7,13-14H2,1-2H3/b17-11-
Classification Click here for help
Compound class Synthetic organic
Approved drug? Yes
IUPAC Name Click here for help
International Nonproprietary Names Click here for help
INN number INN
1790 dosulepin
Synonyms Click here for help
Dothep® | dothiepin | Prothiaden®
Database Links Click here for help
Specialist databases
GPCRdb Ligand dosulepin
Other databases
CAS Registry No. 113-53-1
ChEMBL Ligand CHEMBL108947
GtoPdb PubChem SID 223365885
PubChem CID 5282426
Search Google for chemical match using the InChIKey PHTUQLWOUWZIMZ-BOPFTXTBSA-N
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UniChem Compound Search for chemical match using the InChIKey PHTUQLWOUWZIMZ-BOPFTXTBSA-N
UniChem Connectivity Search for chemical match using the InChIKey PHTUQLWOUWZIMZ-BOPFTXTBSA-N
Wikipedia Dosulepin