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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	VORTIOXETINE
Molecular formula	C18H22N2S
IUPAC name	1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine
Molecular weight	298.448
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	4.2
Synonyms	7034AB BCP05996 D03WEX HY-15414 Piperazine, 1-(2-((2,4-dimethylphenyl)thio)phenyl)- UNII-3O2K1S3WQV W-5909 1-[2-(2,4-Dimethylphenylsulfanyl)-phenyl]piperazine 1-{2-[(2,4-dimethylphenyl)sulfanyl]phenyl}piperazine AC-27648 CCG-229998 Lu AA 21004 pound>>LuAA21004 pound>> Lu-AA21004 pound>> Lu AA21004 pound>> AA21004 SC-53652 Vortioxetine (Lu AA21004) 1-(2-((2,4-Dimethylphenyl)sulfanyl)phenyl}piperazine API0019472 CHEMBL2204360 GTPL7351 MolPort-023-298-791 STL483777 Vortioxetine, Lu AA21004 1-[2-(2,4-dimethyl-phenylsulfanyl)-phenyl]-piperazine BDBM50400902 D10184 KB-81458 Piperazine, 1-[2-[(2,4-dimethylphenyl)thio]phenyl]- vortioxetina YQNWZWMKLDQSAC-UHFFFAOYSA-N 1-[2-(2,4-dimethylphenylsulfanyl)phenyl]piperazine 3O2K1S3WQV AJ-86685 CHEBI:76016 FT-0686961 Lu AA 21004\|\|\|1-[2-[(2,4-dimethylphenyl)thio]phenyl]-piperazine SCHEMBL236115 Vortioxetine (USAN) 1-(2-((2,4-Dimethylphenyl)thio)phenyl)piperazine 508233-74-7 AX8224799 CS-1471 HSDB 8250 PIP107 Trintellix vortioxetinum 1-[2-(2,4-dimethylphenyl)sulfanylphenyl]piperazine A3926 Brintellix (TN) DA-42264 KS-0000062Y SB16506 ZINC34051848 1-[2-[(2,4-Dimethylphenyl)thio]phenyl]piperazine 4CH-016292 AKOS016008748 CHEMBL2104993 GG-0052 Lu AA21004 ST2408515 Vortioxetine [USAN:INN] 1-(2-((2,4-DIMETHYLPHENYL)THIO)PHENYL)PIPERAZINE HYDROCHLRIDE [ Show all ]
Inchi Key	YQNWZWMKLDQSAC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H22N2S/c1-14-7-8-17(15(2)13-14)21-18-6-4-3-5-16(18)20-11-9-19-10-12-20/h3-8,13,19H,9-12H2,1-2H3
PubChem CID	9966051
ChEMBL	N/A
IUPHAR	7351
BindingDB	50400902
DrugBank	DB09068
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
416748	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
416742	5-hydroxytryptamine receptor 1B	P28222	HTR1B	Homo sapiens (Human)	390
555362	5-hydroxytryptamine receptor 1D	P28565	Htr1d	Rattus norvegicus (Rat)	374
416751	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
416749	5-hydroxytryptamine receptor 2C	P28335	HTR2C	Homo sapiens (Human)	458
416745	5-hydroxytryptamine receptor 5A	P47898	HTR5A	Homo sapiens (Human)	357
416743	5-hydroxytryptamine receptor 6	P50406	HTR6	Homo sapiens (Human)	440
416741	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
416747	Beta-1 adrenergic receptor	P08588	ADRB1	Homo sapiens (Human)	477
462752	Beta-2 adrenergic receptor	P07550	ADRB2	Homo sapiens (Human)	413
416750	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487
416744	Histamine H2 receptor	P25021	HRH2	Homo sapiens (Human)	359

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